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#YearAuthorsReferenceTopicTitle
5992018Karimi M, Marchisio D, Laurini E., Fermeglia M. Pricl S.2018;178, 39-47Chemical Eng. ScienceLink to PDF DocumentBridging the gap across scales: coupling CFD and MD/GCMC in polyurethane foam simulations
6032018Carta A., Sanna G., Briguglio I., Madeddu S., Vitale G., Piras S., Corona P. Peana A.T., Laurini E., Fermeglia M., Pricl S., Serra A., Carta E., Loddo R., Giliberti G.2018; https://doi.org/10.1016/j.ejmech.2017.12.083 European Journal of Medicinal ChemistryLink to PDF DocumentQuinoxaline derivatives as new inhibitors of coxsackievirus B5
6022018Marson D,. Laurini E., Fermeglia M., Smith D.K., Pricl S.2018; DOI https://doi.org/10.1016/j.fluid.2017.11.005Fluid Phase EquilibriaMallard Blue binding to heparin, its SDS micelle-driven de- complexation, and interaction with human serum albumin: A combined experimental/modeling investigation
5982018Laurini E., Fermeglia, M., Pricl S. 2018; 1, 28-49In "Membrane Engineering for the Treatment of Gases ", Drioli E., Barbieri G., Brunetti A. (eds), RCS, 2017, Vol.1, 2nd Ed.Link to PDF DocumentMaterials by design: multiscale molecular modelling for the design of nanostructured membranes
6072018Laurini E., Marson D., Fermeglia M., Pricl S. 2018; 26, 28-38Journal of Computational ScienceLink to PDF DocumentMultimodel approach for accurate determination of industry-drivenproperties for Polymer Nanocomposite Materials.
5922017Hinman SS, Ruiz CJ, Cao Y, Ma MC, Tang J, Laurini E, Posocco P, Giorgio S, Pricl S, Peng L, Cheng Q2017;9(1):1029-1035ACS Applied Materials and InterfacesMix and match: coassembly of amphiphilic dendrimers and phospholipids creates robust, modular, and controllable interfaces
5932017Weber F, Brust P, Laurini E, Pricl S, Wünsch B2017;964:31-48Advances in Experimental Medicine and BiologyFluorinated PET tracers for molecular imaging of σ1 receptors in the central nervous system
5902017Rodrigo AC, Bromfield SM, Laurini E, Posocco P, Pricl S, Smith DK2017;53(47):6335-6338Chemical CommunicationsMorphological control of self-assembled multivalent (SAMul) heparin binding in highly competitive media
6002017Rodrigo A.C., Laurini E., Vieira V.M.P., Pricl S., Smith D.K. 2017;53,11580-11583Chemical CommunicationsEffect of buffer at nanoscale molecular recognition interfaces - electrostatic binding of biological polyanions
5962017Ferkl P., Toulec M., Laurini E., Pricl S., Fermeglia M., Aufarth S., Eling B., Settels V., Kosek J.2017, 172, 323-334Chemical Eng. ScienceLink to PDF DocumentMulti-scale modelling of heat transfer in polyurethane foams
5912017Albanyan B, Laurini E, Posocco P, Pricl S, Smith DK2017;23(26):6391-6397Chemistry - A European JournalSelf-assembled multivalent (SAMul) polyanion binding-impact of hydrophobic modifications in the micellar core on DNA and heparin binding at the peripheral cationic ligands
5862017Wünsch B, Kokornaczyk A, Schepmann D, Yamaguchi J, Itami K, Laurini E, Fermeglia M, Pricl S2017; 12, 1070-1080 ChemMedChemThiazole-based sigma-1 receptor ligands: Diversity by late-stage C-H arylation of thiazoles, structure affinity and selectivity relationships and molecular interactions
6042017Chiarappa G., Piccolo A., Colombo I., Hasa D., Voinovich D., Moneghini M., Grassi G., Farra R., Abrami M., Posocco P., Pricl S., Grassi M.2017;17, 4072-4083Crystal Growth & DesignExploring the Shape Influence on Melting Temperature, Enthalpy, and Solubility of Organic Drug Nanocrystals by a Thermodynamic Model
6062017Pengo P., Sologan M., Pasquato L., Guida F., Pacor S., Tossi A., Stellacci F., Marson D., Boccardo S., Pricl S., Posocco P.2017;46, 749-771European Biophysics JournalGold nanoparticles with patterned surface monolayers for nanomedicine: current perspectives
6012017Briguglio I., Laurini E., Pirisi M.A., Piras S., Corona P., Fermeglia M., Pricl S., Carta A.2017;141,460-472European Journal of Medicinal ChemistryTriazolopyridinyl-acrylonitrile derivatives as antimicrotubule agents: Synthesis, in vitro and in silico characterization of antiproliferative activity, inhibition of tubulin polymerization and binding thermodynamics
5972017Laurini E, Posocco P, Fermeglia M, Pricl S2017; 3, 83-112In "Clay-polymer nanocomposites. Morphology, structure, properties and applications", Jlassi K, Chehimi MM, Thomas S (eds.), Elsevier Ltd, 2017 Multiscale molecular modeling of clay-polymer nanocomposites
5952017Laurini E, Marson D, Fermeglia M, Pricl S2017; 244,27-50In "Handbook of experimental Pharmacology", eds. F.J Kim and G.W. Pasternak, Springer 2017Link to PDF Document3D homolgy model of sigma 1 receptor
5942017Vieira VMP, Liljeström V, Posocco P, Laurini E, Pricl S, Kostiainen MA, Smith DK B, 2017;5(2):341-347Journal of Materials ChemistryEmergence of highly-ordered hierarchical nanoscale aggregates on electrostatic binding of self-assembled multivalent (SAMul) cationic micelles with polyanionic heparin
5872017Colombo C, Belfiore A, Paielli N, De Cecco L, Canevari S, Laurini E, Fermeglia M, Pricl S, Verderio P, Bottelli S, Fiore M, Stacchiotti S, Palassini E, Gronchi A, Pilotti S, Perrone F2017; 11, 1495-1507Molecular Oncologyβ-catenin in desmoid-type fibromatosis: deep insights on the role of T41A and S45F mutations on protein structure and gene expression
5882017Andrieu C, Ziouziou H, Laurini E, Karaki S, Baylot V, Fermeglia M, Dusetti N, Camplo M, Siri O, Pricl S, Katsogiannou M, Rocchi P2017; 8,77317-77329 OncotargetTargeting Hsp27/eIF4E interaction with phenazine compound: a promising alternative for castration-resistant prostate cancer treatment
5892017Perfetti V, Laurini E, Aulic S, Fermeglia M, Riboni R, Lucioni M, Dallera E, Delfanti S, Pugliese L, Latteri FS, Pietrabissa A, Pricl S2017; 8:56158-56167OncotargetMolecular and functional characterization of a new 3’ end KIT juxtamembrane deletion in a duodenal GIST treated with neoadjuvant Imatinib
5852017Genini D, Brambilla L, Laurini E, Merulla J, Civenni G, Pandit S, D'Antuono R, Perez L, Levy DE, Pricl S, Carbone GM, Catapano CV2017; 114, e4924-e4933 Proceedings of the National Academy of Science (PNAS)Mitochondrial dysfunction induced by a SH2 domain-targeting STAT3 inhibitor leads to metabolic synthetic lethality in cancer cells
5762016Şologan, Maria; Marson, Domenico; Polizzi, Stefano; Pengo, Paolo; Boccardo, Silvia; Pricl, Sabrina; Posocco, Paola; Pasquato, Lucia2016; 10:9316-9325ACS NanoPatchy and Janus Nanoparticles by Self-Organization of Mixtures of Fluorinated and Hydrogenated Alkanethiolates on the Surface of a Gold Core
5792016Chan, Ching W.; Laurini, Erik; Posocco, Paola; Pricl, Sabrina; Smith, David K.2016; 52:10540-10543Chemical CommunicationsChiral recognition at self-assembled multivalent (SAMul) nanoscale interfaces – enantioselectivity in polyanion binding
5772016Fechner, LE; Albanyan, B; Vieira, VMP; Laurini, E; Posocco, P; Pricl, S; Smith, DK2016; 7:4653-4659Chemical ScienceElectrostatic binding of polyanions using self-assembled multivalent (SAMul) ligand displays – structure–activity effects on DNA/heparin binding
5732016Zampieri, Daniele; Vio, Luciano; Fermeglia, Maurizio; Pricl, Sabrina; Wünsch, Bernhard; Schepmann, Dirk; Romano, Maurizio; Mamolo, Maria Grazia; Laurini, Erik2016; 121:712-726European Journal of Medicinal ChemistryComputer-assisted design, synthesis, binding and cytotoxicity assessments of new 1-(4-(aryl(methyl)amino)butyl)-heterocyclic sigma 1 ligands
5712016A. Carta, I. Briguglio, S. Piras, P. Corona, R. Ibba, E. Laurini, M. Fermeglia, S. Pricl, N. Desideri, E.M. Atzori, P. La Colla, G. Collu, I. Delogu, R. Loddo2016;117: 321-334European Journal of Medicinal ChemistryLink to PDF DocumentA combined in silico/in vitro approach unveils common molecular requirements for efficient BVDV RdRp binding of linear aromatic N-polycyclic systems
5662016E. Laurini, D. Marson, P. Posocco, M. Fermeglia, S. Pricl2016; 422:18-31Fluid Phase EquilibriaLink to PDF DocumentStructure and binding thermodynamics of viologen-phosphorous dendrimers to human serum albumin: a combined computational/experimental investigation.
5802016Estrada, Martín; Pérez, Concepción; Soriano, Elena; Laurini, Erik; Romano, Maurizio; Pricl, Sabrina; García, José A Morales; Pérez-Castillo, Ana; Rodríguez-Franco, María Isabel2016; 8:1191-1207Future Medicinal ChemistryNew neurogenic lipoic-based hybrids as innovative Alzheimer’s drugs with σ-1 agonism and β-secretase inhibition
5692016Petrescu L., Fermeglia M., Cormos C-C2016; 133: 294-303Journal of Cleaner ProductionLink to PDF DocumentLife Cycle Analysis applied to acrylic acid production process with different fuels for steam generation
5742016Laurini, Erik; Posocco, Paola; Fermeglia, Maurizio; Pricl, Sabrina2016; 15:24-33Journal of Computational ScienceMoDeNa Nanotools: An integrated multiscale simulation workflow to predict thermophysical properties of thermoplastic polyurethanes
5782016Weber, Frauke; Brune, Stefanie; Börgel, Frederik; Korpis, Katharina; Lange, Carsten; Bednarski, Patrick J; Laurini, Erik; Fermeglia, Maurizio; Pricl, Sabrina; Schepmann, Dirk; Wünsch, Bernhard2016; 59:5505-5519Journal of Medicinal ChemistryRigidity versus flexibility: is this an issue in S1 (sigma-1) receptor ligand affinity and activity?
5752016Posocco, P.; Hassan, Y. Mohamed; Barandiaran, I.; Kortaberria, G.; Pricl, S.; Fermeglia, M.2106; 120:7403-7411Journal of Physical Chemistry. C Combined Mesoscale/Experimental Study of Selective Placement of Magnetic Nanoparticles in Diblock Copolymer Films via Solvent Vapor Annealing
5612016Posocco P, Perazzo A, Preziosi V, Laurini E, Pricl S, Guido S.2016; 6:4723-4729.RSC AdvancesInterfacial tension of oil/water emulsions with mixed non-ionic surfactants: comparison between experiments and molecular simulations
5622016Beiranvand Z, Bani F, Kakanejadifard A, Laurini E, Fermeglia M, Pricl S, Adeli M.2016; 6:11266-11277.RSC AdvancesAnticancer drug delivery systems based on specific interactions between albumin and polyglicerol
5702016Chen C, Posocco P., Liu X., Cheng Q.,Laurini E., Zhou J., Liu C., Wang Y., Tang J., Dal Col V., Yu T., Giorgio S., Fermeglia M., Qu F., Liang Z., Rossi J.J., Liu M., Rocchi P., Pricl S., Peng L.2016; 12:3667-3676SmallLink to PDF DocumentMastering Dendrimer Self-Assembly for Effi cient siRNA Delivery: From Conceptual Design to In Vivo Effi cient Gene Silencing
5722016Z. Posel, P. Posocco, M. Lısal, M. Fermeglia, S. Pricl2016; 12:3600-3611Soft MatterLink to PDF DocumentHighly grafted polystyrene/polyvinylpyridine polymer gold nanoparticles in a good solvent: effects of chain length and composition
5402015Zampieri D,, Laurin E, Vio L, Fermeglia M, Pricl S, Wuensch B, Schepmann D, Mamolo MG.,2015;90:797-808.European Journal of Medicinal ChemistryImproving selectivity preserving affinity: New piperidine-4-carboxamide derivatives as effective sigma-1-ligands.
5542015Briguglio I, Loddo R, Laurini E, Fermeglia M, Piras S, Corona P, Giunchedi P, Gavini E, Sanna G, Giliberti G, Ibba C, Farci P, La Colla P, Pricl S, Carta A.2015; 105:63-79.European Journal of Medicinal ChemistrySynthesis, citotoxicity and antiviral evaluation of new sereis of imidazo[4,5-g]quinoline and pyrido[2,3-g]quinoxalinone derivatives
5462015Chendo C, Moreira G, Tintaru A, Posocco P, Laurini E, Lefay C, Gigmes D, Viel S, Pricl S, Charles L.2015;26(9):1483-1493.Journal of the American Society for Mass SpectroscopyAnomerization of acrylated glucose during traveling wave ion mobility spectrometry
5392015Rossi D, Marra A, Rui M, Laurini E, Fermeglia M, Pricl S, Schepmann D, Wuensch B, Peviani M, Curti D, Collina S.,2015,6,138-146.MedChemCommA step forward in the sigma enigma: a role for chirality in the sigma1 receptor–ligand interaction?
5312015Pricl S, Cortelazzi B, Dal Col V, Marson D, Laurini E, Fermeglia M, Licitra L, Pilotti S, Bossi P, Perrone F2015;9(2):389-397.Molecular OncologySmoothened (SMO) receptor mutations dictate resistance to vismodegib in basal cell carcinoma
5452015Brambilla L, Genini D, Laurini E, Merulla J, Perez L, Fermeglia M, Carbone GM, Pricl S, Catapano CV2015;9(6):1194-1206.Molecular OncologyHitting the right spot: Mechanism of action of OPB-31121, a novel and potent inhibitor of the Signal Transducer and Activator of Transcription 3 (STAT3)
5532015Morgan A, Gandin I, Belcaro C, Palumbo P, Palumbo O, Biamino E, Dal Col V, Laurini E, Pricl S, Bosco P, Carella M, Ferrero GB, Romano C, D'Adamo AP, Faletra F, Vozzi D.2015; 781:32-36.Mutation ResearchTargeting sequencing approach intended to discover new mutations in non.syndromic intellectual disability
5322015Marson D, Laurini E, Poocco P, Fermeglia M, Pricl S2015;7(9):3876-3887.NanoscaleLink to PDF DocumentCationic carbosilane dendrimers and oligonucleotide binding: an energetic affair
5422015Piscitelli M, Buonocore G, Lavorgna M, Verdolotti L, Pricl S, Gentile G, Mascia L.2015;63:222-229.PolymerPeculiarities in the structure-properties relationship of epoxy-silica hybrids with highly organic siloxane domains.
5412015Wei T, Chen C, Liu J, Liu C, Posocco P, Liu X, Cheng Q, Huo S, Liang Z, Fermeglia M, Pricl S, Liang X, Rocchi P, Peng L.2015;112(10):2978-2983.Proceedings of the National Academy of Science (PNAS)Link to PDF DocumentAnticancer drug nanomicelles formed by self-assembling amphiphilic dendrimer to combat cancer drug resistance.
5522015Mehrabadi, FS, Hirsch, O, Zeisig, R, Posocco, P, Laurini E, Pricl, S, Haag, R, Kemmer, W, Calderon. M.2015; 5:78760-78770.RSC AdvancesStructure-activity relationship study of dendriric polyglycerolamines for efficient siRNA transfection
5102014Tintaru A., Chendo C., Wang Q., Viel S., Quéléver G., Peng L., Posocco P., Pricl, S. , Charles L.2014;808:163-74. Analytica Chimica ActaConformational sensitivity of conjugated poly(ethylene oxide)-poly(amidoamine) molecules to cations adducted upon electrospray ionization - A mass spectrometry, ion mobility and molecular modeling study
5282014Liu X, Zhou J, Yu T, Chao Chen C, Cheng Q, Sengupta K, Huang Y, Li H, Cheng Liu C, Yang Wang Y, Posocco P, Wang M, Cui Q, Giorgio S, Fermeglia M, Qu F, Pricl S, Shi Y, Liang Z, Rocchi P, Rossi JJ,Peng L2014;53(44):11822-11827.Angewandte ChemieAdaptive amphiphilic dendrimer based nanoassemblies as robust and versatile siRNA delivery systems
5232014Brune S, Schepmann D, Klempnauer K-H, Marson D, Dal Col V, Laurini E, Fermeglia M, Wünsch B, Pricl S2014;53(18):2993-3003.BiochemistryThe sigma enigma: in silico/in vitro site directed mutagenesis studies unveil σ1 receptor ligand binding.
5192014Zampieri D, Laurini E, Vio L, Golob S, Fermeglia M, Pricl S, Mamolo MG.2014;24(4):1021-5. Bioorganic & Medicinal Chemistry LettersSynthesis and receptor binding studies of some new arylcarboxamide derivatives as sigma-1 ligands.
5172014Bromfield SM, Posocco P, Chan CW, Calderon M, Guimond SE, Turnbull JE, Pricl S, Smith DK. 2014;5:1484-92.Chemical ScienceNanoscale self-assembled multivalent (SAMul) heparin binders in highly competitive, biologically relevant, aqueous media
5262014Bromfield SM, Posocco P, Fermeglia M, Tolosa J, Herreros-López A, Pricl S, Rodríguez-López J, Smith DK.2014;20(31):9666-74.Chemistry - A European JournalShape-persistent and adaptive multivalency: rigid transgeden (TGD) and flexible PAMAM dendrimers for heparin binding.
5272014Laurini E, Harel D, Marson D, Schepmann D, Schmidt TJ, Pricl S, Wünsch B.2014;83:526-33.European Journal of Medicinal ChemistryIdentification, pharmacological evaluation and binding mode analysis of novel chromene and chromane based σ1 receptor ligands.
5292014Posocco P., Pricl S., Fermeglia M.2014; pp:21-49.in “Sol-Gel Nanocomposites. Advances in Sol-Gel Derived Materials and Technologies””, Eds: Massimo Guglielmi, Guido Kickelbick, Alessandro Martucci, Springer 2014Modelling and Simulation of Sol-Gel Nanocomposites
5202014Weber F, Brune S, Korpis K, Bednarski PJ, Laurini E, Dal Col V, Pricl S, Schepmann D, Wünsch B.2014;57(7):2884-94.Journal of Medicinal ChemistrySynthesis, Pharmacological Evaluation, and σ1 Receptor Interaction Analysis of Hydroxyethyl Substituted Piperazines.
5212014Kala S, Mak AS, Liu X, Posocco P, Pricl S, Peng L, Wong AS.2014;57(6):2634-42.Journal of Medicinal ChemistryCombination of dendrimer-nanovector-mediated small interfering RNA delivery to target akt with the clinical anticancer drug Paclitaxel for effective and potent anticancer activity in treating ovarian cancer.
5132014Barnard A., Posocco P., Fermeglia M., Tschiche A., Calderon M., Pricl S., Smith D.K.2014;12:446-55. Organic & Biomolecular ChemistryDouble-degradable responsive self-assembled multivalent arrays - temporary nanoscale recognition between dendrons and DNA
5242014Wang Y, Liu X, Laurini E, Posocco P, Ziarelli F, Fermeglia M, Qu F, Pricl S, Zhang C-C-,Peng L 2014;12(26):4723-4729.Organic & Biomolecular ChemistryLink to PDF DocumentMimicking 2-oxoglutaric acid signalling function using molecular probes: insights from structural and functional investigations
5182014Gibbons DL, Pricl S, Posocco P, Laurini E, Fermeglia M, Sun H, Talpaz M, Donato N, Quintás-Cardama A.2014;111(9):3550-5.Proceedings of the National Academy of Science (PNAS)Molecular dynamics reveal BCR-ABL1 polymutants as a unique mechanism of resistance to PAN-BCR-ABL1 kinase inhibitor therapy.
4952013Rossi D, Pedrali A, Gaggeri R, Marra A, Pignataro L, Laurini E, Dal Col V, Fermeglia M, Pricl S, Schepmann D, Wünsch B, Peviani M, Curti D, Collina S.2013;21(9):2577-86.Bioorganic & Medicinal ChemistryIdentification of RC-33 as a potent and selective σ1 receptor agonist potentiating NGF-induced neurite outgrowth in PC12 cells. Part 2: g-scale synthesis, physicochemical characterization and in vitro metabolic stability
4982013Laurini E, Dal Col V, Wunsch B, Pricl S2013;23(10):2868-71.Bioorganic & Medicinal Chemistry LettersAnalysis of the molecular interactions of the potent analgesic S1RA with the σ1 receptor
4942013Amadio M., Pascale A., Govoni S., Laurini E., Pricl S., Gaggeri R., Rossi D., Collina S.2013;81(6):707-14.Chemical Biology & Drug DesignIdentification of peptides with ELAV-like mRNA stabilizing effect: an integrated in vitro/in silico approach
4992013Bromfield SM, Posocco P, Fermeglia M, Pricl S, Rodriguez-Lopez J, Smith DK2013;49(42):4830-2.Chemical CommunicationsLink to PDF DocumentA simple new competition assay for heparin binding in serum applied to multivalent PAMAM dendrimers
5082013Rossi D, Pedrali A, Gaggeri R, Marra A, Pignataro L, Laurini E, Dal Col V, Fermeglia M, Pricl S, Schepmann D, Wünsch B, Peviani M, Curti D, Collina S.2013;8(9):1514-27.ChemMedChemChemical, pharmacological, and in vitro metabolic stability studies on enantiomerically pure RC-33 compounds: promising neuroprotective agents acting as σ1 receptor agonists
5112013Fermeglia M., Posocco P., Pricl S.2013;20(6):379-94.Composite InterfacesNano tools for macro problems: Multiscale molecular modeling of nanostructured polymer systems
4932013Posocco P., Pricl S., Fermeglia M.1:95-128 (2013)In "Modeling and Prediction of Polymer Nanocomposite Properties" edited by Vikas Mittal, Wiley-VCH Verlag GmbH & CoMultiscale Modeling Approach for Polymeric Nanocomposites
5152013Quéléver G., Bouillon C. , Moreno P., Tintaru A., Charles L. , Pricl S., Peng L.2013:167-178. In Dendrimers in Biomedical ApplicationsPoly(Aminoester) dendrimers: design, synthesis and characterization
5162013Liu X., Posocco P., Liu C., Yu T., Wang Q., Dal Col V., Chen C., Wang Y., Rocchi P., Pricl S., Peng L.2013:73-83.In Dendrimers in Biomedical ApplicationsPoly(amidoamine) (Pamam) Dendrimers as non‐viral vectors for the delivery of RNA therapeutics
5062013Tintaru A, Pricl S, Denbigh L, Liu X, Peng L, Charles L.2013;354-355:235-41.International Journal of Mass SpectrometryConformational changes of small PAMAM dendrimers as a function of their charge state: A combined electrospray mass spectrometry, traveling-wave ion mobility and molecular modeling study
5032013Brune S, Pricl S, Wünsch B.2013;56(24):9809-19.Journal of Medicinal ChemistryStructure of the σ1 receptor and its ligand binding site
4922013Bromfield SM, Barnard A, Posocco P, Fermeglia M, Pricl S, Smith DK2013;135(8):2911–4.Journal of the American Chemical SocietyLink to PDF DocumentMallard Blue – A High-Affinity Selective Heparin Sensor which Operates in Highly-Competitive Media
5072013Bozzi F, Conca E, laurini E, Posocco P, Lo Sardo A, Jocollè G, Sanfilippo R, Gronchi A, Perrone F, Tamborini E., Pelosi G, Pierotti MA, Maestro R, Pricl S, Pilotti S.2013;93(11):1232-40.Laboratory InvestigationIn vitro and in silico studies of MDM2/MDMX isoforms predict Nutilin-3A sensitivity in well/de-differentiated liposarcomas
5142013Tanis I., Karatasos K., Posocco P., Laurini E., Pricl S.2013;331-332:34–42.Macromolecular SymposiaComplexes between poly(amido amine) dendrimers and poly(methacrlyic acid): insight from molecular dynamics simulations
4962013Conca E, Miranda C, Dal Col V, Fumagalli E, Pelosi G, Mazzoni M, Fermeglia M, Laurini E, Pierotti MA, Pilotti S, Greco A, Pricl S, Tamborini E.2013;7(4):756-62.Molecular OncologyAre two better than one? A novel double-mutant KIT in GIST that responds to Imatinib
5042013Laurini E, Posocco P, Fermeglia M, Gibbons DL, Quintás-Cardama A, Pricl S.2013;7(5):968-75. Molecular OncologyThrough the open door: Preferential binding of dasatinib to the active form of BCR-ABL unveiled by in silico experiments
5052013Posocco P, Liu X, Laurini E, Marson D, Chen C, Liu C, Fermeglia M, Rocchi P, Pricl S, Peng L.2013;10(8):3262-73. Molecular PharmaceuticsImpact of siRNA overhangs for dendrimer-mediated siRNA delivery and gene silencing
4972013Welsh DJ, Posocco P, Pricl S, Smith DK.2013;11(19):3177-86.Organic & Biomolecular ChemistryLink to PDF DocumentSelf-assembled multivalent RGD-peptide arrays – morphological control and integrin binding
5092013X. Liu, Y. Wang, E. Laurini, P. Posocco, H. Chen, F. Ziarelli, A. Janicki, F. Qu,M. Fermeglia, S.Pricl, C.-C. Zhang. L.Peng 2013,15(18):4662-5. Organic LettersLink to PDF DocumentStructural requirements of 2‑oxoglutaricacid analogues to mimic its signaling function
5122013Ottaviani M.F., Cangiotti M., Fattori A., Coppola C., Posocco P., Laurini E., Liu X., Liu C., Fermeglia M., Peng L., Pricl S.2014;16(2):685-94.Physical Chemistry Chemical PhysicsCopper(ii) binding to flexible triethanolamine-core PAMAM dendrimers: a combined experimental/in silico approach
4902013Posel Z., Posocco P., Fermeglia M., Lisal M., Pricl S.2013;9:2936-46. Soft MatterModeling hierarchically structured nanoparticle/diblock copolymer systems
4672012Nieto DR, Santese F, Toth R, Posocco P, Pricl S, Fermeglia M2012, 4 (6), 2855–2859.ACS Applied Materials and InterfacesLink to PDF DocumentSimple, Fast, and Accurate In silico Estimations of Contact Angle, Surface Tension, and Work of Adhesion of Water and Oil Nanodroplets on Amorphous Polypropylene Surfaces.
4792012Posocco P, Gentilini C, Bidoggia S, Pace A, Franchi P, Lucarini M, Fermeglia M, Pricl S, Pasquato L.2012, 6(8):7243-53.ACS NanoLink to PDF DocumentSelf-Organization of Mixtures of Fluorocarbon and Hydrocarbon Amphiphilic Thiolates on the Surface of Gold Nanoparticles.
4742012Gibbons DL, Pricl S, Kantarjian H, Cortes J, Quintás-Cardama A.2012;118:293-9.CancerLink to PDF DocumentThe rise and fall of gatekeeper mutations? The BCR-ABL1 T315I paradigm
4772012Yi Xia, Stephane Viel, Yang Wang, Fabio Ziarelli, Erik Laurini, Paola Posocco, Maurizio Fermeglia, Fanqi Qu, Sabrina Pricl, Ling Peng2012;48(36):4284-6.Chemical CommunicationsRationalizing the F...S Interaction Discovered within a Tetrafluorophenylazido-containing Bola-Phospholipid
4842012Posocco P, Laurini E, Col VD, Marson D, Karatasos K, Fermeglia M, Pricl S.2012;19:5062-87.Current Medicinal ChemistryLink to PDF DocumentTell Me Something I Do Not Know. Multiscale Molecular Modeling of Dendrimer/Dendron Organization and Self-Assembly In Gene Therapy.
4612012Toth R., Santese F., Pereira S.P., Romero-Nieto D., Pricl S., Fermeglia M., Posocco P.2012, 22, 5398-5409.Journal of Materials ChemistryLink to PDF DocumentSize and shape matter! A multiscale molecular simulation approach to polymer nanocomposites
4782012Meyer C, Schepmann D, Yanagisawa S, Yamaguchi J, Dal Col V, Laurini E, Itami K, Pricl S, Wünsch B2012;55(18):8047–65.Journal of Medicinal ChemistryPd-catalyzed direct C-H bond functionalization of spirocyclic sigma-1 ligands: generation of a pharmacophore model and analysis of reverse binding mode by docking into a 3D homology model of the sigma-1 receptor.
4882012Castillo U.J, Zolotukhin M.G., Fomina L, Romero Nieto D., Olivera Garza L., Fomine S.DOI 10.1007/s00894-012-1610-1Journal of Molecualar modelingLink to PDF DocumentReactions of ketones with aromatics in acid media. The effect of trifluoromethyl groups and the acidity media. A theoretical study
4692012Karatasos K, Posocco P, Laurini E, Pricl S.2012, 12(2):225-40.Macromolecular BiosciencePoly(amidoamine)-based Dendrimer/siRNA Complexation Studied by Computer Simulations: Effects of pH and Generation on Dendrimer Structure and siRNA Binding.
4872012Laurini E, Marson D, Dal Col V, Fermeglia M, Mamolo MG, Zampieri D, Vio L, Pricl S.2012;9(11):3107-26.Molecular PharmaceuticsAnother brick in the wall. Validation of the σ1 receptor 3D model by computer-assisted design, synthesis, and activity of new σ1 ligands
4682012Liu X, Liu C, Laurini E, Posocco P, Pricl S, Qu F, Rocchi P, Peng L.2012;9(3):470-81.Molecular PharmaceuticsLink to PDF DocumentEfficient delivery of sticky siRNA and potent gene silencing in a prostate cancer model using a generation 5 triethanolamine-core PAMAM dendrimer
4762011Erik Laurini, Valentina Dal Col, Maria Grazia Mamolo, Daniele Zampieri, Paola Posocco, Maurizio Fermeglia, Luciano Vio, Sabrina Pricl2011;2:834-839.ACS Medicinal Chemistry LettersLink to PDF DocumentHomology Model and Docking-Based Virtual Screening for Ligands of the sigma 1 Receptor.
4732011Liu X, Wu J, Yammine M, Zhou J, Posocco P, Viel S, Liu C, Ziarelli F, Fermeglia M, Pricl S, Victorero G, Nguyen C, Erbacher P, Behr JP, Peng L.22:2461-73 (2011)Bioconjugate ChemistryLink to PDF DocumentStructurally flexible triethanolamine core PAMAM dendrimers are effective nanovectors for DNA transfection in vitro and in vivo to the mouse thymus
4912011Fermeglia M., Toma L., Longo G.2011, pp 165-176, ISBN-10: 1845645103 | ISBN-13: 978-1845645106 Ecosystems and Sustainable Development (ECOSUD), Alicante, SProcess sustainability prediction: a computer aided design tool for the sustainable industrial development.
4912011Fermeglia M., Toma L., Longo G.2011, pp 165-176, ISBN-10: 1845645103 | ISBN-13: 978-1845645106 In "Ecosystems and Sustainable Development VIII " Y. Villacampa (Author, Editor), C. A. Brebbia (Author, Editor), 2011Process sustainability prediction: a computer aided design tool for the sustainable industrial development.
4432011Dileo P., Pricl S., Tamborini E., Negri T., Stacchiotti S., Gronchi A., Posocco P., Laurini E., Coco P., Fumagalli E., Casali P.G., Pilotti S.128:983-90 (2011)International Journal of CancerLink to PDF DocumentImatinib response in two GIST patients carrying two hitherto functionally uncharacterized PDGFRA mutations: An imaging, biochemical and molecular modeling study
4602011Pereira S.P, Scocchi G., Toth R., Posocco P., Romero-Nieto D., Pricl S., Fermeglia M.3:151-176(2011) Journal of Multiscale ModellingLink to PDF DocumentMultiscale modeling of polymer/clay nanocomposites
4712011Barnard A, Posocco P, Pricl S, Calderon M, Haag R, Hwang ME, Shum VW, Pack DW, Smith DK.2011;133:20288-300.Journal of the American Chemical SocietyLink to PDF DocumentDegradable self-assembling dendrons for gene delivery: experimental and theoretical insights into the barriers to cellular uptake.
4572011Jones S..P, Gabrielson N.P., Wong C.H., Chow H.F., Pack D.W., Posocco P., Fermeglia M., Pricl S., Smith D.K.8:416-29 (2011)Molecular PharmaceuticsLink to PDF DocumentHydrophobically Modified Dendrons: Developing Structure-Activity Relationships for DNA Binding and Gene Transfection
4582011Pierotti M., Tamborini E., Negri T., Pricl S., Pilotti S.2011;8:161-170.Nature Reviews Clinical OncologyLink to PDF DocumentTargeted therapy in GIST: in silico modeling for prediction of resistance
4752011Liu X, Chen H, Laurini E, Wang Y, Dal Col V, Posocco P, Ziarelli F, Fermeglia M, Zhang CC, Pricl S, Peng L.2011;13:2924-7.Organic LettersLink to PDF Document2-difluoromethylene-4-methylenepentanoic acid, a paradoxical probe able to mimic the signaling role of 2-oxoglutaric acid in cyanobacteria.
4592011Fermeglia M.CD:5 (2011)TNT 2011, Trends in Nanotechnology, Tenerife, SNano tools for macro problems: multiscale molecular modeling of nanostrucured systems
4522010Fermeglia M., Pricl S.Conference CD and WebACS - American Chemical Society, Boston, USMultiscale molecular modeling: a nano-engineering tool for the design of hybrid organic/inorganic materials
4532010Pricl SConference CDACS - American Chemical Society, Boston, USIs variety the spice of life?
4512010Fermeglia M, Posocco P., Pricl S. Handgraaf J.W.Conference CDAIChE Annual Meeting 2010, American Institute of Chemical Engineering, Salt Lake City, USMultiscale Molecular Modeling of Polymer/Silica Nanocomposites
4542010Pricl S., Posocco P., Fermeglia M., Karatasos K., Peng L., Smith D.K.Conference CDAIChE Annual Meeting 2010, American Institute of Chemical Engineering, Salt Lake City, USThe Sound of Silence. Multiscale Molecular Simulations and Experiments in Developing Nanocarrier/Nucleic Acid Systems
4362010Tonelli M., Boido V., La Colla P., Loddo R., Posocco P., Paneni M.S., Fermeglia M., Pricl S.18:2304-2316 (2010)Bioorganic & Medicinal ChemistryLink to PDF DocumentPharmacophore modeling, resistant mutant isolation, docking, and MM-PBSA analysis: Combined experimental/computer-assisted approaches to identify new inhibitors of the bovine viral diarrhea virus (BVDV)
4422010Tonelli M., Simone M., Tasso B., Novelli F., Boido V., Sparatore F., Paglietti G., Pricl S., Giliberti G., Blois S., Ibba C., Sanna G., Loddo R., La Colla P.18:2937-2953 (2010)Bioorganic & Medicinal ChemistryLink to PDF DocumentAntiviral activity of benzimidazole derivatives. II. Antiviral activity of 2-phenylbenzimidazole derivatives
4482010Giliberti G., Ibba C., Marongiu E., Loddo R., Tonelli M., Boido V., Laurini E., Posocco P., Fermeglia M., Pricl S.18:6055-6068 (2010)Bioorganic & Medicinal ChemistryLink to PDF DocumentSynergistic experimental/computational studies on arylazoenamine derivatives that target the bovine viral diarrhea virus RNA-dependent RNA polymerase
4392010Laurini E., Zampieri D., Mamolo M.G., Vio L., Zanette C., Florio C., Posocco P., Fermeglia M., Pricl S.20:2954-2957 (2010)Bioorganic & Medicinal Chemistry LettersLink to PDF DocumentA 3D-Pharmacophore Model for sigma-2 Receptors Based on a Series of Substituted Benzo[d]oxazol-2(3H)-one Derivatives
4462010S. Pricl,D. L. Gibbons,P. Posocco,E. Laurini,M. Fermeglia,H. M. Kantarjian,M. Talpaz,J. Cortes,M. Young,H. Sun,L. F. Peterson,N. Donato,A. Quintas-Cardama116-21:1392-1393 (2010)BloodThe Novel BCR-ABL1 V304D Mutation Induces Pan-Tyrosine Kinase Inhibitor Resistance by a Unique Kinase Lateral Escape Mechanism and Is Associated with Very Poor Prognosis In Patients (PTS) with Chronic Myeloid Leukemia (CML)
4452010Posocco P., Pricl S., Jones S., Barnard A., Smith D.K.1:393-404 (2010)Chemical ScienceLink to PDF DocumentLess is more: multiscale modelling of self-assembling multivalency and its impact on DNA binding and gene delivery
4402010Pavan G.M., Posocco P., Tagliabue A., Maly M., Malek A., Danani A., Ragg E., Catapano C.V., Pricl S.16:7781-7795 (2010)Chemistry - A European JournalLink to PDF DocumentPAMAM Dendrimers for siRNA Delivery: Computational and Experimental Insights
4412010Jones S.P., Pavan G.M., Danani A., Pricl S., Smith D.K.16:4519-4532 (2010)Chemistry - A European JournalLink to PDF DocumentQuantifying the Effect of Surface Ligands on Dendron-DNA Interactions: Insights into Multivalency through a Combined Experimental and Theoretical Approach
4502010Fermeglia M., Pricl S.Conference CDEMCC6 - European Medirranean Chemical Engineering Conference, Antalya, TurkeyMultiscale molecular modeling for nanostructured hybrid inorganic/organic materials
4472010Piscitelli F., Posocco P., Toth R., Fermeglia M., Pricl S., Mensitieri G., Lavorgna M.351:108-115 (2010)Journal of Colloid and Interface ScienceLink to PDF DocumentSodium Montmorillonite silylation: unexpected effect of the aminosilane chain length
4442010Posocco P., Fermeglia M., Pricl S.20:7742-7753 (2010)Journal of Materials ChemistryLink to PDF DocumentMorphology prediction of block copolymers for drug delivery by mesoscale simulations
4492010Posocco P., Posel Z., Fermeglia M., Lisal M., Pricl S.20:10511-10520 (2010)Journal of Materials ChemistryLink to PDF DocumentA molecular simulation approach to the prediction of the morphology of self-assembled nanoparticles in diblock copolymers
3842010Cosoli P., Fermeglia M., Ferrone M.,19: 72-87 (2010)Journal of Soil and Sediment ContaminationMolecular Simulation of Atrazine Adhesion and Diffusion in a Saturated Sand Model, Journal of Soil and Sediment Contamination
4352010Pierotti M.A., Negri T., Tamborini E., Perrone F., Pricl S., Pilotti S.4:19-37 (2010)Molecular OncologyLink to PDF DocumentTargeted Therapies: The Rare Cancer Paradigm
4552010Fermeglia M., Posocco P., Toth R., Pereira S.P.S.B., Pricl S.Conference CDNanotechItaly, Convegno Italiano di Nanotecnologie, Venezia, IMultiscale Molecular Modeling of Polymer/Silica Nanocomposites
4562010Pricl S., Posocco P., Laurini E., Fermeglia M., Karatasos K., Peng L., Smith D.K.Conference CD and WebNanotechItaly, Convegno Italiano di Nanotecnologie, Venezia, IWhen virtual and real meet: computational/experimental evidences for designing efficient nanovectors for siRNA/DNA delivery
4182009Fermeglia M.CD (2009)Accelrys Science Forum 2009, Paris, FMolecular modeling for nanostructured polymer systems of industrial interest
3772009Fermeglia M., Longo G., Toma L.55: 1065-1078 (2009)AIChE JournalLink to PDF DocumentComputer aided design for sustainable industrial processes: specific tools and applications
3992009Zampieri D., Mamolo M.G., Laurini E., Fermeglia M., Posocco P., Pricl S., Banfi E., Scialino G., Vio, L.17:4693-4707(2009)Bioorganic & Medicinal ChemistryLink to PDF DocumentAntimycobacterial activity of new 3,5-disubstituted 1,3,4-oxadiazol-2(3H)-one derivatives. Molecular modeling investigations.
4002009Tonelli M., Vazzana I., Tasso B., Boido V., Sparatore F., Fermeglia M., Paneni M.S., Posocco P., Pricl S., La Colla P., Ibba C., Secci B., Collu G., Loddo, R.17:4425-4440(2009)Bioorganic & Medicinal ChemistryLink to PDF DocumentAntiviral and cytotoxic activities of aminoarylazo compounds and aryltriazene derivatives.
3982009Scocchi G,;Posocco P., Handgraaf J.W., Fraaije J.G.E.M., Fermeglia M., Pricl, S.15:7586-7592(2009)Chemistry - A European JournalLink to PDF DocumentA complete multiscale modelling approach for polymer-clay nanocomposites.
4062009Fermeglia M., Pricl S.33:1701-1710 (2009)Computers & Chem.EngLink to PDF DocumentMultiscale molecular modeling in nanostructured material design and process system engineering
4162009Fermeglia M., Pricl S.COSMO-RS Symposium 2009, Koln, March 2009COSMO-RS and process simualtion:from physical properties to environmental impact
4172009Fermeglia M., Posocco P., Pricl S., Fraaije J., Handgraaf J-W., Scocchi G., Danani A.1:26 (2009)Eurofillers 2009, June 21 - 25, AlessandriaA Complete Multiscale Modeling Approach for Nanocomposites
4372009Carta A., Pricl S., Piras S., Fermeglia M., La Colla,P., Loddo R.44:5117-5122 (2009)European Journal of Medicinal ChemistryLink to PDF DocumentActivity and molecular modeling of a new small molecule active against NNRTI-resistant HIV-1 mutants
4202009Posocco P., Fermeglia M., Pricl S.FOMMS2009, Foundation of Molecular Modelling and Simulation, Semiahmoo Resort Blane, Washington, USAMulholland Dr. Multiscale molecular modeling of the self-assembly of di/triblock copolymers for drug delivery
4212009Pricl S., Posocco P., Pavan G.M., Fermeglia M., Scocchi G., Malek A., Maly M., Danani A., Catapano C., Peng L., Smith D.K.FOMMS2009, Foundation of Molecular Modelling and Simulation, Semiahmoo Resort Blane, Washington, USAThe sound of silence. Experimental/computational investigations of dendrimer-based sirna/dna delivery systems
4252009Pricl S.In "Handbook of Nanophysics", (seven volume set) edited by Klaus D. SattlerPolymer Clay Nanocomposites
3862009Fermeglia M., Pricl S.1: 261-270 (2009)In "IUTAM Symposium on Modelling Nanomaterials and Nanosystems", edited by Pyrz R. and Rauhe J.C., Springer-Verlag, Berlin, D (2009)Link to PDF DocumentMultiscale molecular Mmdelling of dispersion of nanoparticles in polymer systems of industrial interest
3862009Fermeglia M., Pricl S.1: 261-270 (2009)IUTAM Symposium on Modelling Nanomaterials and Nanosystems, Aalborg, DLink to PDF DocumentMultiscale molecular Mmdelling of dispersion of nanoparticles in polymer systems of industrial interest
4242009Zampieri D., Mamolo M., Laurini E., Florio C., Zanette C., Fermeglia M., Posocco P., Paneni M.S., Pricl S., Vio, L. 52: 5380-5393 (2009)Journal of Medicinal ChemistryLink to PDF DocumentSynthesis, Biological Evaluation and Three-Dimensional in Silico Pharmacophore Model for σ1 Receptor Ligands Based on a Series of Substituted Benzo[d]oxazol-2(3H)-one Derivatives
3662009Negri T., Pavan G.M., Virdis E., Greco A., Fermeglia M., Pricl S., Pierotti M.A., Pilotti S., Tamborini E.101: 194-204 (2009)Journal of National Cancer InstituteLink to PDF DocumentT670X KIT mutations in gastrointestinal stromal tumors: making sense of missense.
4022009Pavan G.M., Danani A., Pricl S., Smith, D.K.131:9686-9694(2009)Journal of the American Chemical SocietyLink to PDF DocumentModeling the multivalent recognition between dendritic molecules and DNA: Understanding how ligand "sacrifice" and screening can enhance binding.
4342009Toth R., Voorn D.-J., Handgraaf J.-W., Fraaije J.G.E.M., Fermeglia M., Pricl S., Posocco P.42:8260-8270 (2009)MacromoleculesLink to PDF DocumentMultiscale computer simulation studies of water-based montmorillonite/poly(ethylene oxide) nanocomposites
4382009Conca E., Negri T., Gronchi A., Fumagalli E., Tamborini E., Pavan G.M., Fermeglia M., Pierotti M. A., Pricl S., Pilotti S.8:2491-2495 (2009)Molecular Cancer TherapeuticsActivate and resist: L576P-KIT in GIST
3902008Fermeglia M., Pricl S.25:725-1(2008)18th ESCAPE, Lyon, FMultiscale molecular modeling: a tool for the design of nano structured materials
3642008Fermeglia M., Carone M., De Bernardi L., Parenzan M.www.colan.org5th CAPE OPEN European Conference, Cambridge, UKVisual unit Programming with CAPE OPEN Studio .NET
3912008Fermeglia M., Pricl S.CD (2008)5th Chemcial engineering conference for Collaborative research in eastern Mediterranean Countries EMCC5Multiscale molecular modeling for nanostructured materials
3932008Fermeglia M., Maly M., Posocco P., Pricl S.54: 265-269 (2008)Advances in Science and TechnologyLink to PDF DocumentMultiscale Molecular Modeling of Hybrid Organic-Inorganic Nanocomposites of Type I and II
3942008Posocco P., Pavan G., Scocchi G., Handgraaf J.W., Malek A., Maly M., Fermeglia M., Fraaije J., Catapano V., Danani A., Pricl S.57: 154-159 (2008)Advances in Science and TechnologyLink to PDF DocumentBase Invaders. Coupling Experiments and Multiscale Modeling of Dendrimer-Based siRNA Delivery Agents
4072008Fermeglia M., Parenzan M., Carone M., DeBernardi L.paper 397dAICHE Annual Meeting Philadelphia, US, nov. 2008Cape-Open Unit Development with Cape-Open Studio .Net
4082008Pricl S., Posocco P., Mály M., Lisal M., Fermeglia M.paper 404aAICHE Annual Meeting Philadelphia, US, nov. 2008Beyond Patterns to Mechanisms. Multiscale Molecular Simulations of Nanoparticles/block Copolymers Self-Assembled Bulk Nanocomposites
4092008Pricl S., Posocco P., Scocchi G., Fermeglia M., Handgraaf J-W, Fraaije J.paper 702bAICHE Annual Meeting Philadelphia, US, nov. 2008A Complete Multiscale Modeling Approach for Nanocomposites
4102008Fermeglia M., Pricl S., Posocco P., Mály M., Lisal M.paper 734cAICHE Annual Meeting Philadelphia, US, nov. 2008Computer Simulation of Hybrid Organic-Inorganic Nanocomposites
3682008Mazzei M., Nieddu E., Mielea M., Balbia, A., Ferrone M., Fermeglia M., Mazzei M.T., Pricl S., LaColla P., Marongiu F., Ibba C., Loddo R.16:2591-2605 (2008)Bioorganic & Medicinal ChemistryLink to PDF DocumentActivity of Mannich bases of 7-hydroxycoumarin against Flaviviridae
3872008Tonelli M., Boido V., Canu C., Sparatore A., Sparatore F., Paneni M.S., Fermeglia M., Pricl S., La Colla P., Casula L., Ibba C., Collu D., Loddo R.16: 8446-8465 (2008)Bioorganic & Medicinal ChemistryLink to PDF DocumentAntimicrobial and cytotoxic arylazoenamines. Part III: Antiviral activity of selected classes of arylazoenamines.
4262008Angusti A., Manfredini S., Durini E., Ciliberti N., Vertuani S., Solaroli N., Pricl S., Ferrone M., Fermeglia M., Loddo R., Secci B., Visioli A., Sanna T., Collu G., Pezzullo M., La Colla P.56: 423-432 (2008)Chemical and Pharmaceutical BulletinDesign, synthesis and anti flaviviridae activity of N6-, -O- and 5 O-substituted adenine nucleoside analogs
3932008Fermeglia M., Maly M., Posocco P., Pricl S.54: 265-269 (2008)CIMTEC 2008, 3rd International Conference on SMART MATERIALS, STRUCTURES AND SYSTEMS, Acireale, ItalyLink to PDF DocumentMultiscale Molecular Modeling of Hybrid Organic-Inorganic Nanocomposites of Type I and II
3942008Posocco P., Pavan G., Scocchi G., Handgraaf J.W., Malek A., Maly M., Fermeglia M., Fraaije J., Catapano V., Danani A., Pricl S.57: 154-159 (2008)CIMTEC 2008, 3rd International Conference on SMART MATERIALS, STRUCTURES AND SYSTEMS, Acireale, ItalyLink to PDF DocumentBase Invaders. Coupling Experiments and Multiscale Modeling of Dendrimer-Based siRNA Delivery Agents
3632008Cosoli P., Fermeglia M., Ferrone M., Pricl S., Toma L.,CD 1: (2008)CISAP-3 : 3rd International Conference on Safety & Environment in Process, Rome, ItalyMolecular simulation techniques for sustainable technology and environmental applications: general overview and case studies
3962008Fermeglia M., Pricl S.Cd (2008)DPD: addressing deficiencies and establishing new frontiers - CECAM, Lausanne, CHMessage –passing multiscale molecular modeling: mapping atomistic to mesoscale simulation
3882008Fermeglia M., Pricl S.1: 61 (2008)Drug Design and Discovery for Developing Countries, ICS-UNIDO. Trieste, IMultiscale molecular strategies for drug delivery
4192008Fermeglia M., Pricl S.CD (2008)Drug Design and Discovery for Developing Countries, ICS-UNIDO. Trieste, IMultiscale Molecular Strategies for Drug Delivery
2852008Fermeglia M, Pricl S.5: 135-147 (2008)Enciclopedia degli Idrocarburi - Istituto TreccaniLink to PDF DocumentFonti di dati termofisici: banche dati e metodi predittivi
3602008Fermeglia M., Longo G., Toma L.27: 373-383 (2008)Environmental ProgressLink to PDF DocumentCOWAR: A CAPE OPEN Software Module for the Evaluation of Process Sustainability
3852008Lisal M., Cosoli P., Smith W.R., Jain S.K., Gubbins K.E.235: 18-31 (2008)Fluid Phase EquilibriaLink to PDF DocumentMolecular-level simulations of chemical reaction equilibrium for nitric oxide dimerization reaction in disordered nanoporous carbons
3892008Fermeglia M.CD (2008)II Young Polymer Scientists Conference, Terni, IMultiscale modeling of nanostructured materials
3832008Fermeglia M1: 637-654 (2008)In "Hydrogen Technology", edited by Aline Leon, Springer-Verlag, Berlin, D (2008)Hydrogen Technology: Environmental Scope
3952008Fermeglia M., Pricl S.1: 225-242 (2008)In 'Chemical Engineering Greetings to prof. Eliseo Ranzi' edited by M. Dente, AIDIC Milano, 2008Multiscale molecular modeling for the design of nanostructured materials
3612008Maly M., Posocco P., Pricl S., Fermeglia M.47: 5023-5038 (2008)Industrial & Engineering Chemistry ResearchLink to PDF DocumentSelf-Assembly of Nanoparticle Mixtures in Diblock Copolymers: Multiscale Molecular Modeling
3972008Fermeglia M.1:10 (2008)International Seminar on Multiscale Modeling of Polymer Materials, Trondheim, NMultiscale molecular modelling of nanostructured polymer systems of industrila interest
3692008Mensitieri G., Larobina D., Guerra G., Venditto V., Fermeglia M., Pricl S.46:8-15 (2008)Journal of Polymer Science, Part B: Polymer PhysicsLink to PDF DocumentChloroform sorption in nanoporous crystalline and amorphous phases of syndiotactic polystyrene.
4012008Carta A., Piras S., Paglietti G., Pricl S., La Colla, P., Busonera B., Loddo, R.4:194-205(2008)Medicinal Chemistry2(3)-Aryl-thio(oxy)-methylquinoxaline derivatives: A new class of P-glycoprotein-mediated drug efflux inhibitors.
3432008Cosoli P., Scocchi G., Pricl S., Fermeglia M.107: 169-179 (2008)Microporous and Mesoporous MaterialsLink to PDF DocumentMany-scale molecular simulation for ABS-MMT nanocomposites: upgrading of industrial scraps
4032008McAuliffe J.C., Wang W.-L., Pavan G.M., Pricl S., Yang D., Chen S.S., Lazar A.J.F., Pollock R.E., Trent J.C.2:161-163(2008)Molecular OncologyUnlucky number 13? Differential effects of KIT exon 13 mutation in gastrointestinal stromal tumors.
3672008Maly M., Posocco P., Fermeglia M., Pricl S34: 1215-1236 (2008)Molecular SimulationLink to PDF DocumentScripting approach in hybrid organic-inorganic condensation simulation: the GPTMS proof-of-concept.
3732008Cosoli P., Fermeglia M., Ferrone M.34: 1231-1327 (2008)Molecular SimulationLink to PDF DocumentGCMC Simulations in Zeolite MFI and Activated Carbon for Benzene Removal from Exhaust Gaseous Streams
4152008Paneni M.S., Posocco P., De Santo I., Causa F., Netti P.A., Pricl S.NNC: National nanomedicne Conference, Genova, 28-29 February 2008Nanochannels versus macromolecules:a multiscale computational approch of macromolecular transport in confined nanospaces
3652008Pricl S., Pavan G.M., Negri T., Fermeglia M., Pierotti M.A., Pilotti S., Tamborini E.xx:xx-xx (2008)OncogeneThe long and winding road of the KIT juxtamembrane (JXM) domain
3922008Martin L., Kortaberria G., Vazquez A., Fermeglia M., Martinelli L., Sinesi S., Jimeno A., de la Caba K., Mondragon I.29: 782-790 (2008)Polymer CompositesLink to PDF DocumentA comparative study of nanocomposites based on a recycled poly(methyl methacrylate) matrix containing several nanoclays.
3712008Cosoli P., Ferrone M., Pricl S., Fermeglia M.145:86-92 (2008)The Chemical Engineering JournalLink to PDF DocumentHydrogen sulphide removal from biogas by zeolite adsorption-part I: GCMC molecular simulations
3722008Cosoli P., Ferrone M., Pricl S., Fermeglia M.145:93-99 (2008)The Chemical Engineering JournalLink to PDF DocumentHydrogen sulphide removal from biogas by zeolite adsorption-part II: a MD simulation
3532007Posocco P., Scocchi G., Fermeglia M., Pricl S., Ferrari M.1:113 (2007)11th International Conference on Properties and Phase Equilibria for Product and Process Design PPEPPD, Crete, Greece, 2007The nanoroad less travelled. A multiscale approach to self-assembly of dendrimers for cancer therapy
3522007Scocchi G., Posocco P., Danani A., Pricl S., Fermeglia M.261:366-374 (2007)11th International Conference on Properties and Phase Equilibria for Product and Process Design PPEPPD, Crete, Greece, 2007Link to PDF DocumentTo the nanoscale and beyond! Multiscale molecular modelling of polymer-clay nanocomposites
3562007Fermeglia M., Longo G., Toma L.www.colan.com4th CAPE OPEN European Conference, Heidelberg, GermanyA CAPE OPEN Unit Operation for the Evaluation of Environmental Impact of a Chemical Process
3572007Fermeglia M., Parenzan M.www.colan.com4th CAPE OPEN European Conference, Heidelberg, GermanyRecent developments and implementations of CAPE-OPEN in .NET
3622007Fermeglia M., Longo G., Toma L.CD 1: (2007)AIChE Annual Meeting, 4-9 November 2007 Salt Lake City, UtahCAPE OPEN Modules for the Process Sustainability Prediction Framework- Description and Applications.
4042007Fermeglia M., Parenzan M.1:1-1(2007)AIChE Annual Meeting, 4-9 November 2007 Salt Lake City, UtahClass-based cape open interface revisited in net framework
4222007Fermeglia M., Posocco P., Maly M., Pricl S.CD (2007)AIChE Annual Meeting, 4-9 November 2007 Salt Lake City, UtahEnthalpy/entropy effect in the self assembly of a nanoparticle complex system: a multiscale molecular modeling (M3) approach
4052007Martinelli, L.;Sinesi, S.;Toaldo, A.B.;Fermeglia, M.;Posocco, P.;Szczurek, T.;Kozlowski, M.;907:819-823(2007)AIP Conference ProceedingsMolecular modeling at plastic recycling
3372007Carta A., Loriga M., Paglietti G., Ferrone M., Fermeglia M., Pricl S., Sanna T., Ibba C., La Colla P., Loddo R.15: 1914-1927 (2007)Bioorganic & Medicinal ChemistryLink to PDF DocumentDesign, synthesis and preliminary in vitro and in silico antiviral activity of [4,7]phenantrolines and 1-oxo-1,4-dihydro-[4,7]phenantrolines against a single-stranded positive sense RNA genome viruses
3702007Zampieri D., Mamolo M.G., Vio L., Banfi E., Scialino G., Fermeglia M., Ferrone M., Pricl S.15:7444-7458 (2007)Bioorganic & Medicinal ChemistryLink to PDF DocumentSynthesis, antifungal and antimycobacterial activities of new bis-imidazole derivatives, and prediction of their binding to P45014DM by molecular docking and MM/PBSA method.
3442007Cosoli P., Fermeglia M., Ferrone M., Posocco P., Pricl S., Scocchi G.9: 89-94 (2007)Chemical Engineering TransactionLink to PDF DocumentNew materials from multiscale modelling procedures: properties prediction and customisation of polymeric nanocomposites
3582007Fermeglia M., Longo G,. Toma L.9: 761-766 (2007)Chemical Engineering TransactionLink to PDF DocumentDevelopment of a Process Sustainable Prediction (PSP) framework
3592007Fermeglia M., Parenzan M.9: 235-240 (2007)Chemical Engineering TransactionLink to PDF DocumentCape Open interface revisited in term of class-based framework: an implementation in .NET.
3252007Fermeglia M., Pricl S.58:187-199 (2007)Coating Science International - COSI 2006Link to PDF DocumentMultiscale modeling for polymer systems of industrial interest
3552007Fermeglia M., Longo G., Toma L.1:1-10 (2007)ESCAPE17, 17th European Synposyum on Computer Aided Process Engineering, Bucharest, RomaniaLink to PDF DocumentA Hierarchical Approach for the Estimation of Environmental Impact of a Chemical Process: from Molecular Modeling to Process Simulation
3522007Scocchi G., Posocco P., Danani A., Pricl S., Fermeglia M.261:366-374 (2007)Fluid Phase EquilibriaLink to PDF DocumentTo the nanoscale and beyond! Multiscale molecular modelling of polymer-clay nanocomposites
3442007Cosoli P., Fermeglia M., Ferrone M., Posocco P., Pricl S., Scocchi G.9: 89-94 (2007)ICheaP-8, The eight International Conference on Chemical & Process Engineering, Ischia, Ita, 2007Link to PDF DocumentNew materials from multiscale modelling procedures: properties prediction and customisation of polymeric nanocomposites
3582007Fermeglia M., Longo G,. Toma L.9: 761-766 (2007)ICheaP-8, The eight International Conference on Chemical & Process Engineering, Ischia, Ita, 2007Link to PDF DocumentDevelopment of a Process Sustainable Prediction (PSP) framework
3592007Fermeglia M., Parenzan M.9: 235-240 (2007)ICheaP-8, The eight International Conference on Chemical & Process Engineering, Ischia, Ita, 2007Link to PDF DocumentCape Open interface revisited in term of class-based framework: an implementation in .NET.
3142007Cosoli P., Ferrone M., Pricl S., Fermeglia M.7: 228-243 (2007)International Journal of Enviromental Technology and managementGrand canonical Monte Carlo simulations for VOCs adsorption in non-polar zeolites
3482007Scocchi G., Posocco P., Fermeglia M., Pricl S.111: 2143-2151 (2007)Journal of Physical Chemistry BLink to PDF DocumentPolymer-Clay Nanocomposites: A Multiscale Molecular Modeling Approach
3492007Posocco P., Ferrone M., Fermeglia M., Pricl S.40: 2257-2266 (2007)MacromoleculesLink to PDF DocumentBinding at the core. Computational study of structural and ligand binding properties of naphthiridine based dendrimers
4272007Carta A., Loriga M., Piras S., Paglietti G., Ferrone M., Fermeglia M., Pricl S., La Colla P., Collu G., Sanna T., Loddo R.3: 520-532 (2007)Medicinal ChemistrySynthesis and anti-picornaviridae in vitro activity of a new class of helicase inhibitors the N,N bis[4-(1H(2H)-benzotriazol-1(2)-yl)phenyl] alkyldicarboxamides
3252007Fermeglia M., Pricl S.58:187-199 (2007)Progress in Organic CoatingsLink to PDF DocumentMultiscale modeling for polymer systems of industrial interest
3542007Posocco P., Paneni M.S., Pricl Sx: xx-xx (2007)XVI International HIV DRUG RESISTANCE Workshop, Hilton Barbados, Barbados, 2007Non-Nucleoside RT Inhibitors (NNRTIs) research: Breaking Down Resistance Using Advanced Computational Procedures
3452007Fermeglia M., Pricl S.1: 133-152 (2007)XXVIII Convegno Scuola AIM Mario Farina, Materiali polimerici nanostrutturati, Garganno, IModellazione multiscala per sistemi nanocompositi di interesse industriale
3052006Pricl S., Ferrone M., Cosoli P., Paneni M.S., Fermeglia M., Cosentino C., Amato F., Cheng M.C.C., Ferrari M.53: 79-84 (2006)11th International Conferences on Modern Materials and Technologies CIMTEC, Acireale, IT, 2006Link to PDF DocumentRelease of Proteins from Nanochannel Delivery Systems: a Coupled Many-Scale Simulation - Experimental Investigation
3062006Fermeglia M., Ferrone M., Cosoli P., Paneni M.S., Venica R., Sinesi S., Posocco P., Martinelli L.51: 134-139 (2006)11th International Conferences on Modern Materials and Technologies CIMTEC, Acireale, IT, 2006Link to PDF DocumentMany-scale simulation of ABS/PC blends for the automotive industry
3352006Pricl S., Fermeglia M., Tamborini E., Pierotti M.A., Pilotti S.1: 68 (2006)18th EORTC-NCI-AACR Symposium on "Molecular Targets and Cancer Therapeutics", Prague, Cz,Link to PDF DocumentEquilibrium on hold. A computational rationale for the role of kit juxtamembrane mutations in controlling receptor autophosphorylation
3412006Martinelli L., Sinesi S., Baron A.T., Fermeglia M., Posocco P., Szczurek T., Kozłowski M.1:1-5 (2006)5th Central European Conference on 'PLASTICS RECYCLING AND RECOVERY, Wrocław 2006Link to PDF DocumentInnovative molecular modeling approach to up-grade polymeric materials from post industrial rejects
3472006Pricl S., Ferrone M., Paneni M.S., Cosoli P., Fermeglia M., Perrone F., Da Riva L., Tamborini E., Suardi S., Pierotti M.P., Pilotti S.CD 1: 1556 (2006)97th AACR Annual Meeting, Washington, DC, US, 2006Link to PDF DocumentAngels and demons of the guardian of the genome. A coupled modeling-biochemical study of p53 mutants in ovarian cancer
3052006Pricl S., Ferrone M., Cosoli P., Paneni M.S., Fermeglia M., Cosentino C., Amato F., Cheng M.C.C., Ferrari M.53: 79-84 (2006)Advances in Science and TechnologyLink to PDF DocumentRelease of Proteins from Nanochannel Delivery Systems: a Coupled Many-Scale Simulation - Experimental Investigation
3062006Fermeglia M., Ferrone M., Cosoli P., Paneni M.S., Venica R., Sinesi S., Posocco P., Martinelli L.51: 134-139 (2006)Advances in Science and TechnologyLink to PDF DocumentMany-scale simulation of ABS/PC blends for the automotive industry
3322006Cosoli P., Ferrone M., Pricl S., Fermeglia M.paper 9eAIChE Annual Meeting 2006, San Francisco, Ca, USAOdor emission removal from gaseous streams by the use of zeolites: A molecular simulation approach
3332006Pricl S., Toth R., Fermeglia M., Voorn D.J., Ming W.paper 21bAIChE Annual Meeting 2006, San Francisco, Ca, USAA combined experimental/computational approach to the characterization of polymer-clay nanocomposites based on PEO-diacrylate macromolecules
3342006Fermeglia M., Pricl S.paper 21gAIChE Annual Meeting 2006, San Francisco, Ca, USAMultiscale simualtion of self assembly of nanoparticles in diblock copolymers
3262006Cosoli P., Fermeglia M., Ferrone M., Scocchi G., Toth R., Pricl S.CD (2006)AIZ Workshop 2006, Innovative Applications of Layered Materials: from Catalysis to Nanotechnology, Alessandria, ItalyLink to PDF DocumentMultiscale Modeling of ABS montmorillonite System
3272006Fermeglia M., Pricl S.CD (2006)AIZ Workshop 2006, Innovative Applications of Layered Materials: from Catalysis to Nanotechnology, Alessandria, ItalyLink to PDF DocumentSelf-Assembly of Nanoparticle Mixtures in Lamellar Diblock Copolymers: multiscale molecular modeling
3132006Toth R., Ferrone M., Miertus S., Chiellini E., Fermeglia M., Pricl S.7: 1714-1719 (2006)BiomacromoleculesLink to PDF DocumentStructure and energetics of biocompatible polymer nanocomposite sistems: a molecular dynamics study
3182006Pricl S., Ferrone M., Fermeglia M., Amato F., Cosentino C., Cheng M.M.C., Walczak R., Ferrari M.8: 277-290 (2006)Biomedical MicrodevicesLink to PDF DocumentMultiscale modeling of protein transport in silicon membrane nanochannels. Part 1. Derivation of molecular parameters from computer simulations
3192006Pricl S., Ferrone M., Fermeglia M., Amato F., Cosentino C., Cheng M.M.C., Walczak R., Ferrari M.8: 291-298 (2006)Biomedical MicrodevicesLink to PDF DocumentMultiscale modeling of protein transport in silicon membrane nanochannels. Part 2. From molecular parameters to a predictive continuum diffusion model
3382006Fermeglia M., Braiuca P., Gardossi L., Pricl S., Halling P.J.22: 1146-1152 (2006)Biotechnology ProgressLink to PDF DocumentIn Silico Prediction of Medium Effects on Esterification Equilibrium Using the COSMO-RS Method
3292006Pricl S., Salvatori G., Shehata N.1: 71 (2006)Ceramic, Cell and Tissue 10th Annual Seminar & Meeting - materials for scaffolding of biologically engineered systems, Faenza, ItalyWhich kinds of drugs? Which kind of actions?
3302006Fermeglia M., Ferrone M., Cosoli P., Paneni M.S., Cosentino C., Amato F., Cheng M.M.C., Walczak R., Pricl S., Ferrari M.CD 1: 43 (2006)FOMMS2006, Foundation of Molecular Modelling and Simulation, Semiahmoo Resort Blane, Washington, USALink to PDF DocumentDelivered to Perfection at Nanoscale. A Coupled Multiscale Simulation/Experimental Investigation of Protein Release from Nanochannel Delivery Systems
3312006Toth R., Pricl S., Ferrone M., Cosoli P., Voorn D.J, Ming W., van Herk A.M., Fermeglia MCD 1: 42 (2006)FOMMS2006, Foundation of Molecular Modelling and Simulation, Semiahmoo Resort Blane, Washington, USALink to PDF DocumentPolymer-Clay Nanocomposites Based on PEO-Diacrylate Macromolecules: a Combined Computational/Experimental Study
3462006Ferrone M., Fermeglia M., Paneni M.S., Pierotti M.A., Pilotti S., Tamborini E. , Pricl S.CD 1: 41 (2006)FOMMS2006, Foundation of Molecular Modelling and Simulation, Semiahmoo Resort Blane, Washington, USALink to PDF DocumentOf life and Death: Chronic Myeloid Leukemia and the Bcr-Abl/Imatinib Paradigm
3502006Pricl S., Ferrone M., Posocco P., Pavan G.M., Fermeglia M., La Colla P., Loddo R.1: 62-63 (2006)HIV DART 2006: Frontiers in drug development for antiretroviral therapies, Cancun, Mexico, 2006Link to PDF DocumentA new twist for an old song. The DABO story revisited
3512006Pricl S., Ferrone M., Posocco P., Fermeglia M., Sanna G., Collu G., La Colla P., Loddo R., Sias A., Piras S., Carta A.1: 63 (2006)HIV DART 2006: Frontiers in drug development for antiretroviral therapies, Cancun, Mexico, 2006Link to PDF DocumentChasing the evaders. Design, synthesis, activity and molecular modelling of a new small molecule with activity against drug-resistant HIV-1-mutants
3122006Scialino G., Banfi E., Zampieri D., Mamolo M., Vio L., Ferrone M., Fermeglia M., Paneni M.S., Pricl S.58: 76-84 (2006)Journal of Antimicrobial ChemoterapyLink to PDF DocumentAntifungal and antimycobacterial activity of new imidazole and triazole derivatives. A combined and computational approach
3392006Pricl S., Tamborini E., Pierotti M., Pilotti S.98: 1583-1584 (2006)Journal of National Cancer InstituteLink to PDF DocumentLetter to the editor: Response of a KIT-Positive Extra-abdominal Fibromatosis to Imatinib Mesylate and KIT Genetic Analysis
3082006Donolo G., De Simon G., Fermeglia M.158: 1282-1289 (2006)Journal of Power SourcesLink to PDF DocumentSteady state dimulation of energy production from biomass by molten carbonate fuel cells.
3402006Carta A., Loriga G., Pirasa S., Paglietti G., La Colla P., Collu G., Piano M.A., Loddo R., Ferrone M., Fermeglia M., Pricl S.2: 577-589 (2006)Medicinal ChemistryLink to PDF DocumentSynthesis and in vitro evaluation of the anti-viral activity of N-[4-(1H(2H)-benzotriazol-1(2)-yl)phenyl]alkylcarboxamides
3112006Ferrone M., Perrone F., Tamborini E., Paneni M.S., Fermeglia M., Suardi S., Pastore E., Delia D., Pierotti M.A., Pricl S., Pilotti S.5(6):1467-73 (2006)Molecular Cancer TherapeuticsLink to PDF DocumentFunctional analysis and molecular modelling show a preserved wild type activity of p53 C238Y
3002006Tamborini E., Pricl S., Negri T., Lagonigro M.S., Miselli F., Greco A., Gronchi A., Casali P., Ferrone M., Fermeglia M., Pierotti M.A., Pilotti S.25: 6140-6146 (2006)OncogeneLink to PDF DocumentFunctional analyses and Molecular modeling of two c-Kit mutations responsible for Imatinib secondary resistance in GIST patients
3232006Fermeglia M., Cosoli P., Ferrone M., Piccarolo S., Mensitieri G., Pricl S.47:5979-5989 (2006)PolymerLink to PDF DocumentPET/PEN Blends of Industrial Interest as Barrier Materials Part I: Many-Scale Molecular Modeling of PET/PEN Blends.
3202006Fermeglia M., Longo G., Toma L.Stampato in proprioA CAPE OPEN implementation of Waste Reduction (WAR) algorithm for the evaluation of sustainability of industrial processes
3362006Pricl S., Fermeglia M., Tamborini E., Pierotti M.A., Pilotti S.1: 47 (2006)Targeted therapies in cancer: myth or realty? Milan, ItalyLink to PDF DocumentActivity of PKC412 against an Imatinib-resistant gastrointestinal stromal tumor (GIST) carrying a D842V mutation in PDGFR: a combined clinical/modeling study
3242006Fermeglia M., Pricl S.Workshop CRUI-Finmeccanica, Integrazione scienza-ingegneria per le nanotecnologie: la collaborazione fra Finmeccanica e il sistema universitarioLink to PDF DocumentModellazione molecolare multiscala per la progettazione di nanocompositi
3422006Fermeglia M.CD 1: 55 (2006)Workshop on ˝Extraction Technologies for Medicinal and Aromatic Plants", Lucknow, IndiaLink to PDF DocumentRole of Process simulation to extraction technologies for MAPs
3172005Fermeglia M., Cosoli P., Ferrone M., Paneni M.S., Pricl S., Martinelli L., Sinesi S., Candus M.1st International Symposium on Nanostructured and Functional Polymer-Based Materials and Composites, Dresden, Germany, 2005Upgrading block co-polymers from post industrial rejects: a multiscale simulation approach
3072005Toth R., Ferrone M., Miertus S., Chiellini E., Fermeglia M., Pricl S.1: 217 (2005)29th International Conference on Solution Chemistry, Portoroz, Slovenija, 2005Link to PDF DocumentSimulation insight on the structure and energetics of biocompatible polymer nanocomposite systems
3092005Fermeglia M., De Simon G., Donolo G.8: 227-232 (2005)2nd International conference on Hydrogen Era, Palermo, IT, 16-19 october 2005Link to PDF DocumentEnergy production from biomass gasification by molten carbonate fuel cells: process simulation
2982005Pricl S:, Tamborini E., Ferrone M., Paneni M.S., Fermeglia M., Pierotti M.A., Pilotti S.Proceedings Supplement 1: 30-31 (2005)AACR Annual Meeting, Anaheim, CA, US, 2005Link to PDF DocumentCan computational structural biology be of help in rationalizing clinical data? The Abl/imatinib paradigm
2992005Tamborini E., Pricl S., Negri T., Lagonigro M.S., Gabanti E., Greco A., Dagrada G., Miselli F., Ferrone M., Pierotti M.A., Pilotti S.Proceedings Supplement 1: 147-148 (2005)AACR Annual Meeting, Anaheim, CA, US, 2005Link to PDF DocumentBiochemical analyses and molecular modelling of two aminoacidic substitutions detected in two gastrointestinal stromal tumor (GIST) patients showing acquired resistance to imatininb
2932005Pricl S., Ferrone M., Paneni M.S., Fermeglia M.,Tamborini E., Negri T., Lagonigro M.S., Miselli F., Greco A., Pierotti M.A., Pilotti S.11: 9032s (2005)AACR-NCI-EORTC International Conference on Molecular Targets and Cancer Therapeutics: Discovery, Biology, and Clinical Applications, Philadelphia, PA, USALink to PDF DocumentT670X kit mutations in gastrointestinal stromal tumors: making sense of missense
2942005Pricl S., Ferrone M., Paneni M.S., Cosoli P., Fermeglia M., Pierotti M.A., Pilotti S., Tamborini E.CD 2: 393a (2005)AIChE Annual Meeting 2005, Cincinnati, OH, USALink to PDF DocumentChanges and challenges: gist, mutated c-kit and imatinib resistance
2952005Paneni M.S., Ferrone M., Cosoli P., Fermeglia M., Pricl M.CD 2: 393b (2005)AIChE Annual Meeting 2005, Cincinnati, OH, USALink to PDF DocumentWhere are we in hiv research? a novel, computer-based strategy predicting resistance to HIV-1 NNRTIs
2962005Toth R., Ferrone M., Miertus S:, Chiellini E., Fermeglia M., Pricl S.CD 2: 414g (2005)AIChE Annual Meeting 2005, Cincinnati, OH, USALink to PDF DocumentNano-scaled inorganic/biopolymer composites: molecular modeling vistas
2972005Fermeglia M., Ferrone M., Cosoli P., Piccarolo S., Mensitieri G., Pricl S.CD 2: 505b (2005)AIChE Annual Meeting 2005, Cincinnati, OH, USALink to PDF DocumentMany-scale molecular modeling of PET/PEN blends
2862005Mamolo M.G., Zampieri D., Vio L., Fermeglia M., Ferrone M., Pricl S., Scialino G., Banfi E.13: 3797-3809 (2005)Bioorganic & Medicinal ChemistryLink to PDF DocumentAntimycobacterial activity of new 3-substituted 5-(pyridin-4-yl)-3H-1,3,4-oxadiazol-2-one and 2-thione derivatives. Preliminary molecular modelling investigations
2822005Tamborini E., Gabanti E., Lagonigro M.S., Negri T., Pricl S., Pierotti M.A., Pilotti S.65: 1115 (2005)Cancer ResearchLink to PDF DocumentKIT/Val654Ala receptor detected in one imatinib-resistant GIST patient.
3092005Fermeglia M., De Simon G., Donolo G.8: 227-232 (2005)Chemical Engineering TransactionLink to PDF DocumentEnergy production from biomass gasification by molten carbonate fuel cells: process simulation
2932005Pricl S., Ferrone M., Paneni M.S., Fermeglia M.,Tamborini E., Negri T., Lagonigro M.S., Miselli F., Greco A., Pierotti M.A., Pilotti S.11: 9032s (2005)Clinical Cancer ResearchLink to PDF DocumentT670X kit mutations in gastrointestinal stromal tumors: making sense of missense
2842005Fermeglia M.1:1(2005)E-business: fattore di competitività per le imprese del Friuli Venezia Giulia, CCIAA Trieste, Italy, 2005L'evoluzione delle tecnologie informatiche per le imprese e lo stato di adozione delel tecnologie ICT nelle imprese regionali
4132005Fermeglia M.CD (2005)EU Nanotechnology Science Forum, Accelrys, Athens, 7 October 2005Mesoscale Modeling for Polymer systems of industrial interest
4142005Pricl S.Cd (2005)EU Nanotechnology Science Forum, Accelrys, Athens, 7 October 2005Many Scael modeling of materials: from Quantum to Meso
2902005Ferrone M., Fermeglia M., Pricl S., Cosentino C., Amato F., Ferrari M.1: 63 (2005)Euronanoforum 2005 - Nanotechnology and the Health of the EU Citizen in 2020, Edimburgh, UKLink to PDF DocumentDiffusion of proteins in nanochannels. A many-scale simulation approach
2912005Ferrone M., Paneni M.S., Cosoli P., Fermeglia M., Tamborini E., Pierotti M.A., Pilotti S., Pricl S.1:64 (2005)Euronanoforum 2005 - Nanotechnology and the Health of the EU Citizen in 2020, Edimburgh, UKLink to PDF DocumentFighting cancer at the nanoscale: computational structural biology and the Bcr-Abl/Imatinib paradigm
2922005Cosoli P., Ferrone M., Paneni M.S., Fermeglia M., Pricl S.1:90 (2005)Euronanoforum 2005 - Nanotechnology and the Health of the EU Citizen in 2020, Edimburgh, UKLink to PDF DocumentTake a walk on the nano side: structural and energetical analysis of ATP-binding pocket mutations of the cardiac beta-myosin heavy chain implicated in familial hypertrophic cardiomyopathy
3212005Toth R., Ferrone M., Miertus S., Chiellini E., Fermeglia M., Pricl S.Europolymer conference 2005, Gargnano-ItalyStructure and energetics of biocompatible polymer nanocomposite systems: a molecular dynamic study
4122005Fermeglia M.1: 1-10 (2005)Expert Group Meeting on Technologies for hydrogen production and fuel cells, ICS-UNIDO, Trieste, March 7-8, 2005Computer Simulation of Fuel Cell Processes
3102005Fermeglia M., Longo G.8.7FCD240 (2005)First International Hydrogen Energy Congress and Exhibition IHEC 2005, Istanbul, Turkey, 2005Link to PDF DocumentComputer simulation of stationary energy production from biomass by molten carbonate fuel cells.
2542005Fermeglia M, Cudicio A., DeSimon G., Longo G., Pricl S.5:66-79 (2005)Fuel cells: from Fundamentals to SystemsLink to PDF DocumentProcess simulation for molten carbonate fuel cells.
3032005Ferrone M., Pricl S., Fermeglia M., Paneni M.S., Angusti A., Ciliberti N., Buzzoni L., Durini E., Vertuani S., Manfredini S., Loddo R., La Colla P.1: 32-33 (2005)Global Antiviral JournalLink to PDF DocumentThree-dimensional Pharmacophore Modeling of Hindered Nucleoside Analogs (HNAs) as Inhibitors of the Hepatitis C virus NS5B Polymerase
3042005Pricl S., Fermeglia M., Ferrone M., Paneni M.S., Cosoli P., Costi R., Roux A., Artico M., Di Santo R.1: 36-37 (2005)Global Antiviral JournalLink to PDF DocumentNovel Aryl Diketo Acids (ADKs) as Inhibitors of Hepatitis C Virus NS5b RNA-Dependent RNA-Polymerase: Better Understanding Through Molecular Modeling
3222005Angusti A., Auzzas L., Boido V., Canu C., Carta A., Ciliberti N., Ferrone M., Loddo R., La Colla P., Loriga M., Manfredini S., Mazzei M., Nieddu E., Paglietti G., Paneni M.S., Pricl S., Rassu G., Sparatore F., Tasso B., Vitale G.1: 37-38 (2005)Global Antiviral JournalLink to PDF DocumentNon-nucleoside anti-Flaviviridae agents from different molecular classes: a jointed experimental/modeling effort
2572005Manfredini S., Angusti A., Ciliberti N., Durini E., Vertuani S., Buzzoni L., Coslanich A., Fermeglia M., Ferrone M., Paneni M.S., Pricl S., La Colla P., Sanna G., Cadeddu A., Mura M., Loddo R.[ISBN: 978-0-9754188-1-9]: 279-318 (2005)In "Framing the knowledge of viral hepatitis", edited by Rymond F. Schinasi, IHL Press, Arlington MA, US (2005)Hindered nucleoside analogs as hinibitors of HCV RNA-dependent RNA-polymerase: evolving vistas
3282005Fermeglia M.1:6 (2005)International meeting on polymer modelling and its industrial applications, Boras, SwedenMultiscale modeling for polymer systems of industrial interest
2882005Di Santo R., Fermeglia M., Ferrone M., Paneni M.S., Costi R., Artico M., Roux A., Gabriele M., Tardiff K.D., Siddiqui A., Pricl S.48:6304-6314 (2005)Journal of Medicinal ChemistryLink to PDF DocumentA simple but effective three-dimensional chemical feature-based pharmacophore model for diketo acid derivatives as hepatitis C virus RNA-dependent RNA-polymerase inhibitors
2872005Fermeglia M., Ferrone M., Tamborini E., Pricl S.4: 1167-1174 (2005)Molecular Cancer TherapeuticsLink to PDF DocumentTT315I mutated bcr-abl in chronic myeloid leukemia and imatinib: insights from a computational study
3012005Zampieria D., Mamolo M.G., Vio L., Tonzara E., Pricl S., Ferrone M., Scialino G., Banfi E.1: P68 (2005)Second Joint Italian-Swiss Meeting on Medicinal Chemistry, Modena, IT, 2005Link to PDF DocumentSynthesis, antifungal and antimycobacterial activities of new bisimidazole derivatives
3022005Carta A., Loriga M., Paglietti G., Ferrone M., Pricl S., Piano M.A., Meloni M. La Colla P.1:P42 (2005)Second Joint Italian-Swiss Meeting on Medicinal Chemistry, Modena, IT, 2005Link to PDF DocumentSynthesis and antiviral activity of 4,7-Phenantroline derivatives against RNA Viruses
2552005Cudicio A., Fermeglia M., Pricl S.Stampato in proprioDynamic model for molten carbonate fuel cells
3032005Ferrone M., Pricl S., Fermeglia M., Paneni M.S., Angusti A., Ciliberti N., Buzzoni L., Durini E., Vertuani S., Manfredini S., Loddo R., La Colla P.1: 32-33 (2005)The 6th biennial meeting in this HEP DART series, HEP DART 2005 Frontiers in Drug Development for Viral Hepatitis, Big Island, Hawaii, US, 2005Link to PDF DocumentThree-dimensional Pharmacophore Modeling of Hindered Nucleoside Analogs (HNAs) as Inhibitors of the Hepatitis C virus NS5B Polymerase
3042005Pricl S., Fermeglia M., Ferrone M., Paneni M.S., Cosoli P., Costi R., Roux A., Artico M., Di Santo R.1: 36-37 (2005)The 6th biennial meeting in this HEP DART series, HEP DART 2005 Frontiers in Drug Development for Viral Hepatitis, Big Island, Hawaii, US, 2005Link to PDF DocumentNovel Aryl Diketo Acids (ADKs) as Inhibitors of Hepatitis C Virus NS5b RNA-Dependent RNA-Polymerase: Better Understanding Through Molecular Modeling
3222005Angusti A., Auzzas L., Boido V., Canu C., Carta A., Ciliberti N., Ferrone M., Loddo R., La Colla P., Loriga M., Manfredini S., Mazzei M., Nieddu E., Paglietti G., Paneni M.S., Pricl S., Rassu G., Sparatore F., Tasso B., Vitale G.1: 37-38 (2005)The 6th biennial meeting in this HEP DART series, HEP DART 2005 Frontiers in Drug Development for Viral Hepatitis, Big Island, Hawaii, US, 2005Link to PDF DocumentNon-nucleoside anti-Flaviviridae agents from different molecular classes: a jointed experimental/modeling effort
2802004Pricl S., Coslanich A., Fermeglia M., Ferro M., Ferrone M., Paneni M.S., Tamborini E., Negri T., Lagonigro S., Greco A., Gabanti E., Pierotti M.A., Pilotti S.1: 187 (2004)16th EORTC-NCI-AARC Symposium on "Molecular Targets and Cancer Therapeutics", Geneve, Switzerland, 2004Link to PDF DocumentAnalogies in imatinib-resistant threonine-to-isoleucine mutation in bcr-abl, kit and pdgfra: a combined experimental/computational approach
2372004Fermeglia M.1:1(2004)17th Bled e-Commerce Conference, Bled, Slovenia, 2004Microsoft and eCommerce: issues and challanges in the academic space - The case of the University of Trieste
2792004Coslanich A., Fermeglia M., Ferrone M., Paneni M.S., Pricl S., Martinelli L., Sinesi S.Part A - 42: 61-75 (2004)3rd International conference "Computational Modeling and Simulation of Materials" CIMTEC, Acireale, Italy, 2004Link to PDF DocumentDiblock copolymers for the automotive industry: the mesoscopic approach
2792004Coslanich A., Fermeglia M., Ferrone M., Paneni M.S., Pricl S., Martinelli L., Sinesi S.Part A - 42: 61-75 (2004)Advances in Science and TechnologyLink to PDF DocumentDiblock copolymers for the automotive industry: the mesoscopic approach
2712004Pricl S., Fermeglia M., Ferrone M., Coslanich A:, Paneni M.S., Romanel F.1:578c (2004)AIChE Annual Meeting 2004, Austin, Tx, USALink to PDF DocumentMolecular modeling of hydrogen storage in carbon nanotubes: a combined molecular dynamics/ab initio orbital study
2722004Pricl S., Fermeglia M., Ferrone M., Coslanich A., Paneni M.S, Tambori E., Pilotti S.1:67g (2004)AIChE Annual Meeting 2004, Austin, Tx, USALink to PDF DocumentA new mutation affecting the ATP pocket of kit receptor in patients with GIST showing acquired resistance to Imatinib: a coupled experimental and modeling investigation
2732004Fermeglia M, Coslanich A, Ferrone M, Pricl S, Paneni M.S., Humar T, Paglione E.1:45g (2004)AIChE Annual Meeting 2004, Austin, Tx, USALink to PDF DocumentPVC/LDPE incompatible blends for industrial applications: a computational multiscale approach
2742004Coslanich A., Fermeglia M., Ferrone M., Pricl S., Paneni M.S., Martinelli L., Sinesi S., Candus M.1:337c (2004)AIChE Annual Meeting 2004, Austin, Tx, USALink to PDF DocumentUpgrading polymeric materials from post industrial rejects: a multiscale simulation approach
2752004Pricl S., Scocchi G., Fermeglia M., Ferrone M., Coslanich A., Paneni M.S.1:578b (2004)AIChE Annual Meeting 2004, Austin, Tx, USALink to PDF DocumentComputer simulation of polymer-organoclay nanocomposites for packaging applications: from binding energy to interlayer spacing predictions
2762004Paneni M.S., Ferrone M., Coslanich A:, Fermeglia M., Pricl S., Miertus S., Frecer V., Carniel E., Mestroni L.1:448b (2004)AIChE Annual Meeting 2004, Austin, Tx, USALink to PDF DocumentA talk on the motor side. The free energy for mutating V186 and F244 to Leucine in beta-myosin and its ATP binding
2772004Pricl S., Fermeglia M., Ferrone M., Coslanich A., Paneni M.S., Manfredini S., Angusti A., La Colla P., Mura M.1:448a (2004)AIChE Annual Meeting 2004, Austin, Tx, USALink to PDF Document"Fatty" nucleoside analogs as HCV NS5b inhibitors
2782004Pricl S., Fermeglia M., Coslanich A., Ferrone M., Paneni M.S., Caliceti P., Salmaso S., Semenzato S.1: 494b (2004)AIChE Annual Meeting 2004, Austin, Tx, USALink to PDF DocumentDesign, synthesis and characterization of folate-cyclodextrin bioconjugate for active drug delivery: results from combined computational and experimental efforts
2352004Mamolo M.G., Zampieri D., Falagiani V., Vio L., Fermeglia M., Ferrone M., Pricl S., Banfi E., Scialino G.5:231-250 (2004)ArkivocLink to PDF DocumentAntifungal and antimycobacterial activity of new N1-[1-aryl-2-(1H-imidazol-1-yl and 1H-1,2,4-triazol-1-yl)-ethylidene]-pyridine-2-carboxamidrazone derivatives
2592004Metullio L., Ferrone M., Coslanich A., Fuchs S., Fermeglia M., Paneni M.S., Pricl S.5:1371-1378 (2004)BiomacromoleculesLink to PDF DocumentPolyamidoamine (yet not PAMAM) Dendrimers as Bioinspired Materials for Drug Delivery: Structure-Activity Relationships by Molecular Simulations
2532004Fermeglia M., Cudicio A., Desimon G., Longo G, Pricl S.4: 391-396 (2004)Chemical Engineering TransactionLink to PDF DocumentSteady state and Dynamic simulation of molten carbonate fuel cells
2612004Pricl S., Ferrone M., Paneni M.S., Angusti A., Manfredini S., La Colla P., Mura M.1: 115-118 (2004)Convegno GRICU Nuove frontiere di applicazione delle metodologie dell'ingegneria chimicaLink to PDF DocumentDesign, synthesis and activity of hindered nucleoside analogs with anti-Flaviviridae activity, and their interaction with RdRp
2622004Pricl S., Ferrone M., Paneni M.S., Tamborini E., Pilotti S., Pierotti M.A.1: 145-148 (2004)Convegno GRICU Nuove frontiere di applicazione delle metodologie dell'ingegneria chimicaLink to PDF DocumentIs tailor-fitting always the best choice? The case of mutations in GISTs and Imatinib
2632004Paneni M.S., Ferrone M., Pricl S., Carniel E., Miertus S., Frecer V., Mestroni L.1: 253-256 (2004)Convegno GRICU Nuove frontiere di applicazione delle metodologie dell'ingegneria chimicaLink to PDF DocumentGenotype-phenotype correlations of myosin mutations: a molecular simulation study
2642004Ferrone M., Pricl S., Paneni M.S., Tamborini E., Pilotti S., Pierotti M.A.1: 273-276 (2004)Convegno GRICU Nuove frontiere di applicazione delle metodologie dell'ingegneria chimicaLink to PDF DocumentP53 mutations in sporadic and NF1 related malignant peripheral nerve sheath tumors (MPNST): from clinical evidences to a molecular rationale
2652004Fermeglia M., Pricl S., Gardossi L., Halling P.2: 1189 (2004)Convegno GRICU Nuove frontiere di applicazione delle metodologie dell'ingegneria chimicaLink to PDF DocumentPrediction of activities in enzyme-catalyzed reactions from ab initio calculations
2662004Pricl S.2: 1191-1194Convegno GRICU Nuove frontiere di applicazione delle metodologie dell'ingegneria chimicaLink to PDF DocumentFree energy calculations in biological systems
2672004Coslanich A:, Fermeglia M., Candus M., Martinelli L., Sinesi S.2: 955-958 (2004)Convegno GRICU Nuove frontiere di applicazione delle metodologie dell'ingegneria chimicaLink to PDF DocumentModeling of polymer blends for automotive industry by multiscale molecular simulations
2682004Fermeglia M., Coslanich A., Scocchi G., Incarnato L., Russo M.G.2: 1005 (2004)Convegno GRICU Nuove frontiere di applicazione delle metodologie dell'ingegneria chimicaLink to PDF DocumentCharacterization of polymer clay nanocomposites (PCNs) by molecular mdeling: from binding energy to d-spacing predictions
2692004Fermeglia M., Coslanich A., Morellato N., Armellin A., Comper L.2: 1231 (2004)Convegno GRICU Nuove frontiere di applicazione delle metodologie dell'ingegneria chimicaLink to PDF DocumentHow good a surfactant for polymer silicate nanocomposites can be? Answers from atomistic and mesoscale molecular simulations
4112004Fermeglia M.1:1-10 (2004)Expert Group Meeting on The role of process simulation in sustainable industrial development, , ICS-UNIDO, San Marino, 2004ICS past activities and current projects in process simulation and sustainable development
2532004Fermeglia M., Cudicio A., Desimon G., Longo G, Pricl S.4: 391-396 (2004)H2 age: when, where, why, Pisa, Italy, 2004Link to PDF DocumentSteady state and Dynamic simulation of molten carbonate fuel cells
2832004Pricl S., Coslanich A., Fermeglia M., Ferrone M., Paneni M.S., Loddo R., Cabizza A., Sanna G., Murreddu M., La Colla P.1:41-42 (2004)HIV Dart 2004, Montego Bay, Jamaica 2004Link to PDF DocumentPrediction fo HIV-1 resistance to NNRITs: a computer-aided molecular-based rationale
2602004Fermeglia M., Longo G.1:1(2004)International Conference on Renewable resources and renewable energy: a global challange, ICS-UNIDO - Trieste, Italy, 2004Fuel cells and computer simulation: a decision support system in the area of renewable energy
1862004Frecer, V., Kabelac, M., De Nardi, P., Pricl, S., Miertus, S.22: 209-220 (2004)Journal of Molecular Graphics and ModellingLink to PDF DocumentStructure-based design of inhibitors of NS3 serine protease of hepatitis C virus
2502004Fermeglia M., Ferrone M., Pricl S.30:289-300 (2004)Molecular SimulationLink to PDF DocumentEstimation of the binding energy in random poly (butylene terephtalate-co-thiodiethylene terephtalate) copolyesters / clay nanocomposites via molecular simulation
2582004Toth R., Coslanich A., Ferrone M., Fermeglia M., Pricl S., Miertus S., Chiellini E.45:8075-8083 (2004)PolymerLink to PDF DocumentComputer simulation of polypropylene/organoclay nanocomposites: characterization of atomic scale structure and prediction of binding energy
2812004Manfredini S., Angusti A., Veronese A.C, Durini E., Vertuani S., Nalin F., Solaroli N., Ferrone M., Pricl S., Mura M., Piano M.A, Poddesu B., Cadeddu A., La Colla P., Loddo R.76:1007-1015 (2004)Pure and Applied ChemistryLink to PDF DocumentHindered Nucleoside Analogs (HNA) as Antiflaviviridae Agents
2702004Fermeglia M.Strategies for Nanotechnologies: the role of Euro Regions, Agemont, Amaro (UD), Italy, (2004)Computational Chemistry: present situation in Italy and in Friuli Venezia Giulia
3152004Banfi E., Ferrone M., Mamolo M., Pricl S., Scialino G., Vio L., Zampieri D.Third Croatian Congress of Microbiology with International Participation, Porec, Croatia, 2004Molecular modeling in drug design: new chemicals with antitubercolar, antifungal, antibacterial activity: synthesis and MIC evaluation; experimental and computational approach
4232004Fermeglia M.Cd (2004)UNIDO/UNEP National Cleaner production Centres and Programmes, Interlaken, CHExisting initiatives and future collaborations between ICS-UNIDO and NCPC
3162004Zampieri D., Mamolo M., Vio L., Ferrone M., Pricl S., Scialino G., Banfi E.1: 047 (2004)Wolrd Conference on Magic Bullets Celebrating Paul Ehrlich's 150th Birthday, Nurnberg, Germany, 2004Antifungal and antimycobacterial activity of new imidazole and triazole derivatives. A combined experimental and computational approach
2222003Pricl S., Ferrone M., Fermeglia M., Asquini A.CD 1: PMSE 238 (2003)225th ACS National Meeting, New Orleans, Usa, 2003Link to PDF DocumentShape-persistent polyphenylene-based dendrimers: a computational approach
2232003Pricl S., Ferrone M., Fermeglia M., Lodi A., Mazzurco A.CD 1: CARB 55 (2003)225th ACS National Meeting, New Orleans, Usa, 2003Link to PDF DocumentUse of MM-PBSA in reproducing the binding free energy of NSAIDs to b-cyclodextrin
2242003Pricl S., Ferrone M., Fermeglia M., Tamborini E., Delia D., Pierotti M.A., Pilotti S.CD 1: MEDI 74 (2003)225th ACS National Meeting, New Orleans, Usa, 2003Link to PDF DocumentC-kit mutants in GISTs and their interaction with STI 571: insights from computer simulations and clinical trials
2252003Pricl S., Ferrone M., Fermeglia M., Laurent L., Tamborini E., Delia D., Pierotti M.A., Pilotti S.CD 1: MEDI 140 (2003)225th ACS National Meeting, New Orleans, Usa, 2003Link to PDF DocumentCompuational alanine scanning to probe DNA-wild typeand mutant P53 interactions
2262003Pricl S., Ferrone M., Fermeglia M., Lodi A.CD 1: CARB 69 (2003)225th ACS National Meeting, New Orleans, Usa, 2003Link to PDF DocumentMolecular dynamics and free energy analyses of the interactions between b-cyclodextrin and some anticancer drugs
2282003Ferrone M., Coslanich A., Fermeglia M., Felluga F., Pitacco G., Valentin E., Pricl S.1: 55 (2003)5° Convegno FISV, Rimini, I, 2003Link to PDF DocumentEnantioselectivity of alpha-chytripsyn towards 4,5-disubstituted-gamma-lactams: a new perspective from molecular simulations
2402003Pricl S., Coslanich A., Fermeglia M., Ferrone M., Albertini V., Bonadiman L., Tamborini E., Pierotti M.A., Pilotti S.1: 107g (2003)AIChE Annual Meeting 2003, S. Francisco, USALink to PDF DocumentA Tumor (GIST), a Mutated Gene (c-kit), and a Molecular Inhibitor (Imatinib): Insights from Computer Simulations
2412003Pricl S., Coslanich A., Fermeglia M., Ferrone M., Metullio L., Fuchs S.1: 472b (2003)AIChE Annual Meeting 2003, S. Francisco, USALink to PDF DocumentTowards Dendrimers as Anticancer Drug Carriers: from in Silico to in Vivo Characterization
2292003Pricl S., Fermeglia M., Ferrone M., Carrion P.1: 32-51 (2003)Annals of The European Academy of SciencesLink to PDF DocumentShape-persistent polyphenylene dendrimers: a computational study
1912003Manfredini S., Solaroli N., Porcu L., Durini E., Angusti A., Vertuani S., Verri A., Spadai S., Focher F., Ferrone M., Pricl, S., De Clercq E., Balzarini J.14: 183-194 (2003)Antiviral Chemistry & ChemotherapyLink to PDF DocumentDesign, Synthesis and Activity of Phosphonoacetic Acid (Ppa) Ester and Amide Bioisosters of Ribofuranosylnucleoside Diphosphates as Potential Ribonucleotide Reductase Inhibitors.
2342003Caliceti P., Salmaso S., Carofiglio T., Fornasier R., Fermeglia M., Ferrone M., Pricl S.14: 899-908 (2003)Bioconjugate ChemistryLink to PDF DocumentSynthesis and physico-chemical characterization of folate-cyclodextrin bioconjugate for active drug delivery
1852003Fermeglia M., Ferrone M., Lodi A., Pricl S.53: 15-44 (2003)Carbohydrate PolymersLink to PDF DocumentHost-guest inclusion complexes between anticancer drugs and beta-cytclodextrin: computational studies.
2302003Pricl S., Fermeglia M., Ferrone M., Asquini A.41: 2269-2283 (2003)CarbonLink to PDF DocumentScaling properties in the molecular structure of three-dimensional, nanosized phenylene-based dendrimers as studied by atomistic molecular dynamics simulations
2022003Fermeglia M., Pricl S., Longo G.17: 69-79 (2003)Chem. Biochem. Eng. Q.Link to PDF DocumentMolecular modelling and process simulation: real possibilities and challenges
1572003Pricl S., Fermeglia M.190:1267-1292 (2003)Chemical Engineering CommunicationsLink to PDF DocumentAtomistic molecular dynamics simulations of gas diffusion and solubility in rubbery amorphous hydrocarbon polymers
2362003Fermeglia M.1:1(2003)Data Intelligence Expo: anlyze to decide, Milano, Italy, 2003Il ruolo della business intelligence nella riorganizzazione del sistema informativo di una Università
1882003Fattorini, R., Fermeglia M., Gerbino W., Banterle A., Fantoma D.E-learning, Politecnico di Milano, ItalyUniversity Didactics to Companies in e-learning modality: a case study
2442003Coslanich A., Fermeglia M., Ferrone M., Paneni M.S., Pricl S., Caliceti P., Carofiglio T., Fornasier R., Salmaso S., Semenzato A.1: session health & medicine (2003)EuroNanoForum 2003, Trieste, Italy, 2003Link to PDF DocumentIntegrated process of design, synthesis and physicochemical characterization of nanovectors for active drug delivery: the cyclodextrin-folate-bioconjugate example
2452003Coslanich A., Fermeglia M., Ferrone M., Pricl S.1: session functional materials (2003)EuroNanoForum 2003, Trieste, Italy, 2003Link to PDF DocumentThree-dimensional, nanosized phenylene-based dendrimers: scaling properties studied by a computational approach
2462003Coslanich A., Fermeglia M., Ferrone M., Pricl S., Martinelli L., Sinesi S.1: session nanosciences (2003)EuroNanoForum 2003, Trieste, Italy, 2003Link to PDF DocumentInnovative procedures based on advanced mesoscale simulation techniques for functional polymers in automotive industry
2472003Coslanich A., Fermeglia M., Ferrone M., Pricl S., Tamborini E., Oggioni M., Perrone F., Pilotti S., Delia D., Pierotti M.A.1: session health & medicine (2003)EuroNanoForum 2003, Trieste, Italy, 2003Link to PDF DocumentHow the Angstrom modifies the nano: effect of point mutations on the nanodimensional structure of human TP53 point mutations
2482003Coslanich A., Fermeglia M., Ferrone M., Pricl S., Riccio R., Armellin A., Comper L., Morellato N.1: session nanosciences (2003)EuroNanoForum 2003, Trieste, Italy, 2003Link to PDF DocumentComputer–aided based technology in polymer silicate nanocomposites: a new approach for fast screening of good surfactants based on atomistic and mesoscale molecular simulations
2492003Chiellini E., Coslanich A., Fermeglia M., Ferrone M., Meriani S., Miertus S., Pricl S., Toth R.1: session nanosciences (2003)EuroNanoForum 2003, Trieste, Italy, 2003Link to PDF DocumentComputer simulation of polypropylene/organoclay nanocomposites: characterization of atomic scale structure and prediction of the binding energy
1992003Fermeglia M., Ferrone M., Pricl S.212: 315-329 (2003)Fluid Phase EquilibriaLink to PDF DocumentComputer Simulation of nylon/organoclay nanocomposites: prediction of the binding energy
2002003Fermeglia, M., Ferrone,M., Pricl, S.210: 105-116 (2003)Fluid Phase EquilibriaLink to PDF DocumentDevelopment of an all-atoms force field from ab-initio calculations for alterative refrigerants
2312003Ferrone M., Pricl S., Fermeglia M., Asquini A.1:1 (2003)FOMMS2003, Foundation of Molecular Modelling and Simulation, Keyston Resort, CO, USA, (2003)Link to PDF DocumentComputational studies of shape-persistent polyphenylene dendrimers
2322003Pricl S., Fermeglia M., Ferrone M., Manfredini S., Angusti A., Di Santo R., Frecer V., Miertus S.1:1 (2003)FOMMS2003, Foundation of Molecular Modelling and Simulation, Keyston Resort, CO, USA, (2003)Link to PDF DocumentComputer-assisted design of new, potential HCV inhibitors
2332003Coslanich A., Fermeglia M., Ferrone M., Martinelli L., Pricl S.1:1 (2003)FOMMS2003, Foundation of Molecular Modelling and Simulation, Keyston Resort, CO, USA, (2003)Link to PDF DocumentMesoscopic dynamic simulation of diblock copolymers for the automotive industry
2172003Fermeglia M.1:1(2003)Frenesys: l'ebusiness per le piccole e medie imprese, CCIAA Gorizia, Italy, 2003L'impresa nel decennio digitale: ruolo ed evoluzione dell'e-commerce
2422003S. Pricl, A. Coslanich, M. Fermeglia, M. Ferrone, M. Merzek, A. Angusti, N. Ciliberti, E. Durini, S. Manfredini, Chiara Musiu, Massimo Mura, Roberta Loddo, and P. La Colla1: 30-31 (2003)HEP_DART 2003, Kanaui Island (Hawaii), US 2003Link to PDF DocumentSynthesis of a New Series of Nucleoside Analogs with Antiflaviviridae Activity and Their Interaction with RNA-Dependent RNA-Polymerase
1352003Aim K., Fermeglia M.[ISBN: 0-471-49708-8], Chapter 5.1 pag. 491-553, 2003In "The Experimental determination of Solubilities " edited by G.T. Hefter and R.P.T. Tomkins,, John Wiley & Sons (2003)Link to PDF DocumentSolubility of Solids and Liquids in Supercritical Fluids
2102003De Simon G., Parodi F., Fermeglia M., Taccani R.115: 210-218 (2003)Journal of Power SourcesLink to PDF DocumentSimulation of Process for Electrical Energy Production basen on Molten Carbonate Fuel Cells
2392003F. Felluga, G. Pitacco, E. Valentin, A. Coslanich, M. Fermeglia, M. Ferrone, and S. Pricl14: 3385-3399 (2003)Tetrahedron: AsymmetryLink to PDF DocumentStudying enzyme enantioselectivity using combined ab initio and free energy calculations: alfa-chymotrypsin and methyl cis- and trans-5-oxo-2-pentylpirrolidine-3-carboxylates
1942002Ferrone,M., Fermeglia, M., Pricl, S.1: 323-325 (2002)16th European Conference on Thermophysical Properties, IC London UK, 2002Link to PDF DocumentChemical Engineering at the edge of life science. Selected cases of molecular simulations and free-energy calculations for biological and medical applications.
1952002Fermeglia, M., Ferrone,M., Pricl, S.1: 298-299 (2002)16th European Conference on Thermophysical Properties, IC London UK, 2002Link to PDF DocumentNylon-6/organoclay nanocomposites: prediction of the binding energy by molecular simulation
2012002Fermeglia, M., Ferrone,M., Pricl, S.1:HCO2 - 289 (2002)17th IUPAC Conference on Chemical Thermodynamics, Rostock, D, 2002Alternative Refrigerants: Thermophysical Properties and Phase equilibra by computational chemistry
2042002Fermeglia, M., Ferrone, M., Pricl, S., Lodi, A., Caliceti, P., Salmaso, S., Fornasier, R.CD 1: MEDI 87 (2002)224th ACS National Meeting, Boston, Usa, 2002Link to PDF DocumentSynthesis, characterization and molecular modeling of a cyclodextrin-bioconjugate as anticancer drug
2052002Pricl S., Fermeglia M., Ferrone M., Tamborini E., Oggionni M., Perrone F., Delia D., Pilotti S., Pierotti M.A.CD 1: MEDI 234 (2002)224th ACS National Meeting, Boston, Usa, 2002Link to PDF DocumentDetailed Computational Study of Point Mutations of the TP53 Tumor-Suppressor Protein
2072002Pricl S., Felluga F., Pitacco G., Valentin E., Ferrone M.CD 1: ORGN 500 (2002)224th ACS National Meeting, Boston, Usa, 2002Link to PDF DocumentEnantiomerically pure beta,gamma-disubstituted gamma-lactams: Enzyme-mediated synthesis and computational studies
2082002Manfredini S., Augusti A., Durini E., Vertuani S., Nalin F., Verri A., Spadari S., Focher F., Solaroli N., De Clercq E., Balzarini J., Ferrone M., Pricl S.CD 1: MEDI 38 (2002)224th ACS National Meeting, Boston, Usa, 2002Link to PDF DocumentRibonucleotide reductase potential inhibitors: Design, synthesis and activity of bioisosters of ribofuranosylnucleoside diphosphates
2112002Maurizio Fermeglia, and Sabrina PriclCD 1: IEC 35 (2002)224th ACS National Meeting, Boston, Usa, 2002Link to PDF DocumentPrediction of the thermophysical properties and phase behavior of alternative refrigerants via computational chemistry
2122002Sabrina Pricl, Maurizio Fermeglia, and Massimo SimonettaCD 1: IEC 34 (2002)224th ACS National Meeting, Boston, Usa, 2002Link to PDF DocumentGrand canonical Monte Carlo simulations of sorption equilibria in silicalite-1 type zeolite: application to hydrocarbons
2092002Di Santo R., Costi R., Artico M., Fermeglia M., Ferrone M., Lodi A., Manfredini S., Pricl S.1:215-216 (2002)23rd International symposium on the chemistry of natural products (ISCNP-23), Firenze, I, 28/7-2/8, 2002Link to PDF DocumentProbing the activity of diketoacis as HCV NS5B polymerase inhibitors via detailed molecular modeling
1582002Milocco O., Fermeglia M., Pricl S.199:15-21 (2002)2nd International Workshop on Thermochemical, Thermodynamic and Transport Properties of Halogenated Hydrocarbons and mixtures, Paris (France), 2001Link to PDF DocumentPrediction of thermophysical properties of alternative refrigerants by computational chemistry
2032002Ferrone M., Fermeglia M., Pricl S., Tamborini E., Oggioni M., Perrone F., Delia D., Pilotti S. and Pierotti M.1: 5 (2002)4° Convegno FISV, Riva del Garda (TN), I, 2002Link to PDF DocumentHuman TP53 point mutations: structural analysis by molecular modelling
2182002Artico M., Costi R., Di Santo R., Fermeglia M., Ferrone M., Manfredini S., Pricl S.CD 1: 245g (2002)AIChE annual meeting 2002, Indianapolis, USALink to PDF DocumentCan inhibitors of HIV integrase work on HCV polymerase?
2192002Pricl S., Fermeglia M., Ferrone M., Tamborini E., Oggionni M., Perrone F., Pilotti S., Delia D., Pierotti M.A.CD 1: 299c (2002)AIChE annual meeting 2002, Indianapolis, USALink to PDF DocumentDetailed Molecular Modeling of Point Mutations of P53
2202002Fermeglia M., Ferrone M., Pricl S.CD1: 369b (2002)AIChE annual meeting 2002, Indianapolis, USALink to PDF DocumentMolecular modeling of Nylon 6/organoclay nanocomposite: prediction of binding energy
2212002Fermeglia M., Ferrone M., Pricl S.CD 1: 406g (2002)AIChE annual meeting 2002, Indianapolis, USALink to PDF DocumentPrediction of thermophysical properties of alternative refrigerantss by a novel, ab initio force field
1672002Elvassore N., Bertucco A., Fermeglia M.48: 359-368 (2002)AIChE JournalLink to PDF DocumentPhase equilibria calculation by Group-contribution Perturbed Hard Sphere Chain Equation of state
1752002Fermeglia M., Ferrone M., Pricl S10: 2471-2478 (2002)Bioorganic & Medicinal ChemistryLink to PDF DocumentComputer-aided simulation of a dendrimer with a protoporphyrinic core as potential, novel hemoprotein mimic.
2162002Fermeglia M.1:1(2002)Business 2002, La trasformazione delle imprese verso un'economia europea, SIRMI Palmanova, Italy, 2002Case Study: Principe San Daniele
2062002De Nardi P.G., Fermeglia M., Ferrone M., Frecer V., Kabelac M., Miertuš S., Pricl S.1: 10-11 (2002)Controlled Release Society CRS-Italian Chapter WORKSHOP su Bioconiugazione, Padova, Italy, 2002Link to PDF DocumentModellazione molecolare e progettazione di nuovi inibitori della serin proteasi NS3 del virus dell’HCV
2132002Fermeglia M., Ferrone M., Pricl S.1: 11-12 (2002)Controlled Release Society CRS-Italian Chapter WORKSHOP su Ciclodestrine, prorietà e applicazioni, Padova, Italy, 2002Link to PDF DocumentModelllazione molecolare e calcoli di energia libera di binding per complessi di inclusione ciclodestrina-farmaci antitumorali
2142002Pricl S., Fermeglia M., Ferrone M., Lodi A., Caliceti P., Salmaso S., Fornasier R.1: 17-18 (2002)Controlled Release Society CRS-Italian Chapter WORKSHOP su Ciclodestrine, prorietà e applicazioni, Padova, Italy, 2002Link to PDF DocumentA cyclodextrin-bioconjugate as carrier for anticancer drugs: from synthesis to molecular modeling
1662002Longo G., Fermeglia M.1: 35-59 (2002)Expert Group Meeting on The role of process simulation in sustainable industrial development, (2001)The ICS past activity in Process simulation
1582002Milocco O., Fermeglia M., Pricl S.199:15-21 (2002)Fluid Phase EquilibriaLink to PDF DocumentPrediction of thermophysical properties of alternative refrigerants by computational chemistry
1982002Felluga, F., Fermeglia, M., Ferrone, M., Pitacco, G., Pricl, S., Valentin, E.85: 4046-4054 (2002)Helvetica Chimica ActaLink to PDF DocumentChemo-Enzymatic Synthesis and Determination of the Absolute Configuration of Both Enantiomers of trans 5-Oxo-2-pentyl-3-pyrolidine Carboxylic acid Precursor of the Aza Analogues of (+) and (-) Methylenolactocin
2382002Fermeglia M.7: (3) 10-11 (2002)Ita SAS COMLink to PDF DocumentSono applicabili i processi di intelligence alla pubblica amministrazione
1902002Manfredini, S., Solaroli, N., Porcu, L., Angusti, A., Durini, E., Vertuani, S., Verri, A., Spadari, S., Focher, F., Ferrone, M., Pricl, S., De Clercq, E., Balzarini, J.1:315-318 (2002)Proceedings of the 15th International Conference on Antiviral Research (ICAR), Prague, Czech Republic, March 17-21, 2002Phosphonoacetic Acid (PPA) Ester and Amide Bioisosters of Ribofuranosylnucleoside Diphosphates as Potential Ribonucleotide Reductase Inhibitors: Design, Synthesis and Activity.
2382002Fermeglia M.7: (3) 10-11 (2002)SAS i days, The Intelligence days, Milano, ItalyLink to PDF DocumentSono applicabili i processi di intelligence alla pubblica amministrazione
1922002Fermeglia, M., Pricl, S., de Leeuw, V.Stampato in proprioApplication of Vetere method for the prediction of vapour-liquid equilibria for acqueuos systems
1892002Felluga, F., Fermeglia, M., Ferrone, M., Pitacco, G., Pricl, S., Valentin, E.13: 475-489 (2002)Tetrahedron: AsymmetryLink to PDF DocumentComputational studies on the enantioselectivity of alpha-chymotrypsin towards beta-carbomethoxy-gamma-lactams.
2152002Angusti A., Manfredini S., Veronese A. C., Durini E., Vertuani S., Nalin F., Solaroli N., Pricl S., Ferrone M., Mura M., Musiu C., Piano M. A., Poddesu B., Marturana F., La Colla P.CD 1:1(2002)XVI Convegno Nazionale Divisione Chimica Farmaceutica della Società Chimica Italiana, Sorrento, 18-22/9, 2002Progettazione, sintesi ed attività biologica di analoghi nucleosidici ad attività antiflaviviridae
1792001Pricl, S., Martinelli, L., Munari, A., Lotti, N. Favotto, F.1:213-218 (2001)7 Convegno Nazionale di Reologia, Faenza (Italy), 2001Copolimeri metacrilati per l’industria dell’automobile: sintesi e relazioni struttura-proprietà.
1612001S. Pricl, M. Fermeglia1: 171:176 (2001)7 Convegno nazionale di reologia, Faenza, Italia, 2001Confronto del comportamento reologico di alcuni isomeri via simulazione al computer basata su tecniche di dinamica molecolare
1482001M. Fermeglia, S. Pricl47: 2371-2382 (2001)AIChE JournalLink to PDF DocumentPrediction of Phase Equilibria for Binary Mixtures by Molecular Modeling
1592001M. Fermeglia, S. Pricl, D. SulliniAIChE national meeting 2001, Rino, USALink to PDF DocumentPhase equilibria prediction by molecular simulations: comparison of different methods
1622001M. Fermeglia, A. Lodi, S. PriclAIChE national meeting 2001, Rino, USALink to PDF DocumentCyclodextrin as a template for molecular assembly: inclusion complexes with anti - cancer drugs
1632001M. Fermeglia, M. Fratta, S. PriclAIChE national meeting 2001, Rino, USALink to PDF DocumentBSE prion fragment (90-231): pH induced conformational changes and binding with potential inhibitors by molecular dynamics
1652001Fermeglia M., Ferrone M., Pricl S.AIChE national meeting 2001, Rino, USALink to PDF DocumentBiotechnological dendrimers with a protopophynic core: a molecular dynamic study
1802001Felluga, F., Pricl, S.AIChE national meeting 2001, Rino, USALink to PDF DocumentMolecular Simulation of receptor/substrate interaction: the case of alpha-chymotrypsyn and beta-carbomethoxy-gamma-lactems.
1812001De Nardi, P., Fermeglia, M., Pricl, S., Frecer, V., Miertus, S.AIChE national meeting 2001, Rino, USALink to PDF DocumentComputer design of new inhibitors of hepatitis C virus enzymes.
1822001Gelmetti, S., Fermeglia, M., Pricl, S.AIChE national meeting 2001, Rino, USALink to PDF DocumentModeling of molecular interactions and inclusion phenomena of aminoacids and nucleotides in a synthetic dendrimer.
1832001Fermeglia, M., Pricl, S., Degli Esposti, A.AIChE national meeting 2001, Rino, USALink to PDF DocumentPhase equilibria prediction for alternative refrigerants by molecular simulations based on ab initio force fields.
1502001M. Fermeglia, S. Pricl, A. Klamt97: 191-194 (2001)AIChE Symposium SeriesPrediction of thermophysical properties of mixtures using molecular simulations based on density functional theory
1772001Fermeglia, M., Ferrone, M., Gelmetti, S., Pricl, S.,55: 19-26 (2001)AIM MagazineLink to PDF DocumentI dendrimeri, un esempio di molecole biotecnologiche.
1472001S. Pricl, M. Fermeglia45: 23-33 (2001)Carbohydrate PolymersLink to PDF DocumentMolecular simulations of host-guest inclusion compounds: an approach to the lactodendrimers case
1502001M. Fermeglia, S. Pricl, A. Klamt97: 191-194 (2001)Foundations of Molecular Modeling and Simulations, Keystone Resort (Colorado, USA), 2000Prediction of thermophysical properties of mixtures using molecular simulations based on density functional theory
1492001M. Fermeglia, S.Pricl40: 104-110 (2001)Rheologica ActaLink to PDF DocumentVirtual rheological experiments on linear alkane chains confined between titanium walls
1762001Torriano, G., Pricl, S.40:204-210 (2001)Rheologica ActaLink to PDF DocumentClear and Pigmented water epoxy systems: a study on the hardening kinetics on the basis of the variations of the viscoelastic moduli.
1842001Felluga, F., Pitacco, G., Prodan, M., Pricl, S., Visintin, M., Valentin, E.12: 3241-3249 (2001)Tetrahedron: AsymmetryLink to PDF DocumentA chemoenzymatic approach to the synthesis of enantiomerically pure aza analogues of paraconic acid methyl ester and both enantiomers of methyl beta-proline.
1682001Pricl S., Fermeglia M., Fratta M., Forloni G., D'Ursi P.1:555-558 (2001)XV Convegno Italiano di Scienza e Tecnologia della Macromolecole, 2001Link to PDF DocumentStudio dell'interazione di potenziali inibitori con il prione PRP (90-231) della BSE tramite tecniche di dinamica molecolare
1692001Pricl S., Fermeglia M., Lodi A.1:691-694 (2001)XV Convegno Italiano di Scienza e Tecnologia della Macromolecole, 2001Link to PDF DocumentSimulazione molecolare di complessi host-guest: applicazione al caso ciclodestrine - farmaci antitumorali
1702001Pricl S., Fermeglia M., Ferrone M.CD 1: 535-538 (2001)XV Convegno Italiano di Scienza e Tecnologia della Macromolecole, 2001Link to PDF DocumentDendrimeri biotecnologici a nucleo protoporfirinico: studio di dinamica molecolare
1712001Pricl S., Fermeglia M., Giannoccaro M., Lotti N., Munari A.1:33-36 (2001)XV Convegno Italiano di Scienza e Tecnologia della Macromolecole, 2001Link to PDF DocumentCopoliesteri statistici basati sull'acido ftalico: relazioni struttura - proprietà ottenute da simulazioni molecolari
1722001Pricl S., Gelmetti S., Fermeglia M.1:834-837 (2001)XV Convegno Italiano di Scienza e Tecnologia della Macromolecole, 2001Link to PDF DocumentStudio delle interazioni molecolari nei complessi di inclusione tra il poli (aril etere) e aminoacidi o nucleotidi
1732001Pricl S., Fermeglia M., Mazzurco A.1:706-709 (2001)XV Convegno Italiano di Scienza e Tecnologia della Macromolecole, 2001Link to PDF DocumentModellazione molecolare della complessazione di fans in ciclodestrine modificate
1782001Pricl, S., Felluga, F.1:37-40 (2001)XV Convegno Italiano di Scienza e Tecnologia della Macromolecole, 2001Link to PDF DocumentSimulazione molecolare delle interazioni recettore/substrato: il caso dell’alfa-chimotripsina e i beta-carbometossi-gamma-lattami
1532000M. Fermeglia, S. PriclSession 247 - Computational chemistry in design - (2000)AIChE national meeting 2000, Los Angeles, USASeeking for a liaison between molecolar and prosess simulation
1542000V. Ardone, M. Fermeglia, S. PriclSession - Kinetics, Catalysis and reaction engineering - (2000)AIChE national meeting 2000, Los Angeles, USASteric and electronic effects of R in ansa-zirconium metallocene catalysts investigated by molecular simulations
1552000M. Fermeglia, M. Giannoccaro, S. PriclSession 182 - Materials general session - (2000)AIChE national meeting 2000, Los Angeles, USAStatistical copolyesters based on phtalic acid: structure-property relationships obtained from molecular simulations
1562000M. Fermeglia, S. Pricl, A KlamtSession 85 - Thermodynamics propertiesand phase behavior - (2000)AIChE national meeting 2000, Los Angeles, USAPrediction of phase behavior of multicomponent mixtures by molecular quantum mechanics / molecular dynamics simulations
1522000Fermeglia M., Ferrone M., Pricl M.1: 80 (2000)AIChE national meeting 2000, Los Angeles, USALink to PDF DocumentMolecular Simulation of dendrimeric Porphyrins
1282000Favari F., Bertucco A., Elvassore N., Fermeglia M.55: 2379-2392 (2000)Chemical Eng. ScienceLink to PDF DocumentMultiphase multicomponent equilibria for mixtures containing polymers by the perturbation theory.
1512000M. Fermeglia, S. PriclDinamica e controllo non lineare nell'ingegneria di processo, DINIP 2000, Roma, Italy, 2000Bridging molecular and process modeling. The answer is yes, but what was the question?
1742000Fermeglia M., Mensitieri G., Pricl S.Flow Induced Crystallization of Polymers: Impact on processing and manufact prop, Salerno, 2000Grand Canonical Monte Carlo Simulation of Trichloromethane Adsorption in Syndiotactic Poly(styrene) "empty d" form
1932000Fermeglia, M.1: 15 (2000)III Conferenza sul Commercio Elettronico , CCIAA Trieste, 2000Il Progetto Trans Info Network e la promozione del commercio elettronico come fattore di successo nel commercio internazionale
1402000Belloni F., Fermeglia M., Pricl S.25: 53 (2000)Molecular SimulationFrom molecular to process simulation: novel approaches to the prediction of phase equilibria and PVT behaviour based on molecular/quantum mechanics and molecular dynamics simulations.
1442000Blasizza E., Fermeglia M., Pricl S.24: 167 (2000)Molecular SimulationDendrimers as functional materials. A molecular dynamics simulation study of poly(propylene) imine starburst molecules.
1602000M. Fermeglia, S. Pricl1:1 (2000)Seminar on Statistical Mechanics, Bled (SLO), 2000Molecular modeling in chemical engineering: from the prediction of phase behavior to the characterization of complex molecules.
1362000Aim K., Fermeglia M.Stampato in proprioSolids and liquids in supercritical fluids.
1451999Fermeglia M., Pricl S.1: 43-44 (1999)1st International Workshop on Thermochemical, Thermodynamic and Transport Properties of Halogenated Hydrocarbons and mixtures, Pisa (Italy), 1999Molecular simulations for the determination of thermophysical properties of chloro-fluoro-hydrocarbons.
1381999Fermeglia M., Pricl S.1: 43-45 (1999)5th conference on 'Supercritical Fluids and their Applications', Garda, Italy, 1999Molecular dynamics simulation of surfactants in supercritical carbon dioxide.
1421999Belloni F., Klamt A., Fermeglia M., Pricl S.Session 01A02 - General thermodynamics and phase behaviour: equations of state - (1999)AIChE annual meeting, Dallas, US, 1999Using density functional theory calculations to predict phase equilibria for halogenated hydrocarbons.
1431999Blasizza E., Fermeglia M., Pricl S.Session 01A16 - Applying molecular simualtion and computational quantum chemistry I - (1999)AIChE annual meeting, Dallas, US, 1999Investigating some physical properties of poly(propylene)imine by molecular simulations.
1371999Fermeglia M., Pricl S.45: 2619-2627 (1999)AIChE JournalLink to PDF DocumentEquation of state parameters for pure polymers by molecular dynamics simulations.
1961999Grassi, M.;Lapasin, R.;Pricl, S.;173:147-173(1999)Chemical Engineering CommunicationsThe effect of drug dissolution on drug release from swelling polymeric matrices: Mathematical modeling
1231999Fermeglia M., Miertus S., Pizzio F.81: 40-44 (1999)Chimica & IndustriaLink to PDF DocumentProcess simulation and modeling for sustainable industrial development.
1461999Fermeglia M.1: 1-20 (1999)Consultation Workshop for 'Integrated coastal area management', ICS-UNIDO, Trieste, Italy, 1999Process simulation and environmental applications.
1391999Pricl S., Fermeglia M.1: 137-42 (1999)Eurorheo 99-3 - Southern Europe conference on rheology, Calabria, Italy, 1999Rheology of alkane chains confined beteween metal surfaces: a molecular dynamics simulation study.
1101999Fermeglia M., Pricl S.158-160: 49-58 (1999)Fluid Phase EquilibriaLink to PDF DocumentMolecular dynamic simulation of real systems: application to chloro-fluoro-hydrocarbons and polymers.
1111999Bertucco A., Elvassore N., Fermeglia M., Prausnitz J.M.158-160: 183-191 (1999)Fluid Phase EquilibriaLink to PDF DocumentA perturbed-hard-sphere-chain equation of state for phase equilibria of mixtures containing a refrigerant and a lubricant oil.
1291999Pricl S., Fermeglia M.166: 21-37 (1999)Fluid Phase EquilibriaLink to PDF DocumentA novel approach to thermophysical properties prediction in fluid phase equilibria.
1301999Bertucco A., Elvassore N., Fermeglia M.2: 921-3 (1999)Fourth Conference on Chemical and Process Engineering, Firenze, Italy, 1999Group contribution perturbed hard sphere chain equation of state for phase equilibria calculation of normal fluids and high molecular weight compound.
1311999Fermeglia M., Giannoccaro M., Munari A., Pricl S.2: 917-9 (1999)Fourth Conference on Chemical and Process Engineering, Firenze, Italy, 1999Novel biodegradable copolyesters; quantitavie structure-property relationships and molecular dynamics characterization.
1321999Blasizza E., Fermeglia M., Pricl S.2: 881-3 (1999)Fourth Conference on Chemical and Process Engineering, Firenze, Italy, 1999Structure and properties of poly(propylene imine) dendrimers by molecular/quantum mechanics and molecular dynamics simulations.
1331999Fermeglia M., Pricl S.2: 921-3 (1999)Fourth Conference on Chemical and Process Engineering, Firenze, Italy, 1999Phase equilibiria prediction for halogenated hydrocarbons by molecular simulations based on density functional theory.
1341999Belloni F., Fermeglia M., Pricl S.2: 885-7 (1999)Fourth Conference on Chemical and Process Engineering, Firenze, Italy, 1999Determination of perturbed hard sphere chain equation of state parameters for pure polymers via molecular mechanics/molecular dynamics simulations.
1271999Fermeglia M., Torriano G.44: 965-969 (1999)Journal of Chemical & Engineering DataLink to PDF DocumentDensity, viscosity and refractive index for binary systems of n-C16 and four non-linear alkanes at 298.15 K.
1641999Fermeglia M.1:1(1999)Lavoro collaborativo, gestione delal conoscenza e Internet, Area Science Park, Trieste, Italy, 1999Il lavoro collaborativo nell'amministrazione universitaria
1251999Blasizza E., Fermeglia M., Pricl S.www.molsim.edu (1999)Molecular Simulation 1999 MOLSIM99, Internet, 1999Dendrimers as functional materials. A molecular simulation study of poly(propylene) imine starbust molecules.
1261999Belloni F., Fermeglia M., Pricl S.www.molsim.edu (1999)Molecular Simulation 1999 MOLSIM99, Internet, 1999From molecular to process simulation: novel approaches to the prediction of phase equilibria and PVT behavior based on molecular/quantum mechanics and molecular dynamics simulations.
1411999Vrcon R., Fermeglia M., Nabergoj R., Trincas G.1: 131 (1999)Technics & Technology in Fishing Vessels, Ancona, Italy, 1999A database of fishing vessels: design, implementation and web access development.
1241999Fermeglia M., Pricl S.1: 52-53 (1999)Thermodynamics 99, Imperial college, London, UK, 1999A bridge between process and molecular simulations: calculation of equation of state parameters by molecular mechanics molecular dynamics techniques.
1101999Fermeglia M., Pricl S.158-160: 49-58 (1999)VIIIth Int. Conference on 'Fluid Properties and Phase Equilibria for Product and Process Design', Delft, The Netherlands, 1998Link to PDF DocumentMolecular dynamic simulation of real systems: application to chloro-fluoro-hydrocarbons and polymers.
1111999Bertucco A., Elvassore N., Fermeglia M., Prausnitz J.M.158-160: 183-191 (1999)VIIIth Int. Conference on 'Fluid Properties and Phase Equilibria for Product and Process Design', Delft, The Netherlands, 1998Link to PDF DocumentA perturbed-hard-sphere-chain equation of state for phase equilibria of mixtures containing a refrigerant and a lubricant oil.
1161998Fermeglia M., Pricl S.1: 343-345 (1998)AIChE topical conference, Miami Beach, US, 1998Molecular dynamics prediction of PVT behaviour and determination of related thermophysical properties of pure polymers.
1131998Fermeglia M., Bertucco A., Bruni S.17: 3117-3128 (1998)Chemical Eng. ScienceLink to PDF DocumentA perturbed hard sphere chain equation of state for applications to hydrofluorocarbons, hydrocarbons and their mixtures.
1221998Pricl S., Fermeglia M.1:1 (1988)European Material Science Molecular Simulation User group meeting, Paris, France, 1998Determination of EOS parameters via MM/MD techniques.
1171998Fermeglia M., Pricl S.1: 17-22 (1998)Expert group meeting on 'Molecular modeling in Chemistry and Chemical Industry', ICS-UNIDO, Tireste, Italy, 1998A bridge between molecular modeling and process simulation.
1181998Fermeglia M.1: 23-30 (1998)Expert group meeting on 'Molecular modeling in Chemistry and Chemical Industry', ICS-UNIDO, Tireste, Italy, 1998The role of process simulation in modeling in chemistry and chemical industry: an overview.
1141998Fermeglia M., Pricl S.1: 415 (1998)GRICU conference, Ferrara, Italy, 1998Calcolo di proprietà termofisiche mediante esperimenti virtuali: applicazione a fluidi refrigeranti e polimeri.
1151998Fermeglia M., Bertucco A., Elvassore N., Favari F.1: 441 (1998)GRICU conference, Ferrara, Italy, 1998Una equazione di stato per molecole di dimensioni molto diverse basata sulle teorie della perturbazione.
1081998Pricl S., Fermeglia M.1: 22-26 (1998)Joint Conference of Italian, Austrian, Slovenian Rheologists, Trieste, Italy, 1998Prediction of polymer properties in dilute solutions.
1091998Pricl S., Fermeglia M.1: 63-67 (1998)Joint Conference of Italian, Austrian, Slovenian Rheologists, Trieste, Italy, 1998Zero shear viscosity prediction for polymer melts and concentrated polymer solutions.
1121998DeLorenzi L., Fermeglia M., Torriano G.43: 183-186 (1998)Journal of Chemical & Engineering DataLink to PDF DocumentDensity, kinematic viscosity and refractive index for bis(2-ethylhexyl) adipate, tris(2-ethylhexyl) trimellitate and diisononyl phthalate.
1871998Lapasin, R.;Pricl, S.;Sirtori, V.;Casati, D.;27:138-148(1998)Journal of Electronic MaterialsViscoelastic properties of solder pastes
1191998Fermeglia M.1: 12 (1998)Workshop on 'Industry and Environmental Management' ICS-UNIDO & CMESRC, Hanoi, Vietnam, 1998Purification of gas streams and water pollution reduction in chemical plants by process simulation: a case study.
1201998Fermeglia M.1: 13 (1998)Workshop on 'Industry and Environmental Management' ICS-UNIDO & CMESRC, Hanoi, Vietnam, 1998Guidelines and examples of application of process simulation for the solution of environmental problems.
1211998Fermeglia M.1: 11 (1998)Workshop on 'Industry and Environmental Management' ICS-UNIDO & CMESRC, Hanoi, Vietnam, 1998Process simulation fundamentals: theory and applications.
1071997Fermeglia M., Bertucco A., Bruni S.1: 23 (1997)16th European Seminar on Applied Thermodynamics, Pont-a-Mousson, France, 1997A perturbed hard sphere chain equation of state for mixtures of hydrofluorocarbons and hydrocarbons.
1031997DeLorenzi L., Fermeglia M., Torriano G.1: 1 (1997)5th Alpe Adria Rheoworkshop, Novo Mesto, Slovenia, 1997Density, viscosity and refractive index determinations.
1041997Fermeglia M., Bertucco A., Patrizio D. 52: 1517-1527 (1997)Chemical Eng. ScienceLink to PDF DocumentThermodynamic properties of pure hydrofluorocarbons by a perturbed hard sphere chain equation of state.
2271997Copetti, G.;Grassi, M.;Lapasin, R.;Pricl, S.;14:951-961(1997)Glycocojugate JournalSynergistic gelation of xanthan gum with locust bean gum: A rheological investigation
1061997DeLorenzi L., Fermeglia M., Torriano G.42: 919-923 (1997)Journal of Chemical & Engineering DataLink to PDF DocumentDensity, refractive index and kinematic viscosity of diesters and triesters.
2891997Colombo, I.;Grassi, M.;Lapasin, R.;Pricl, S.;47:305-314(1997)Journal of Controlled ReleaseLink to PDF DocumentDetermination of the drug diffusion coefficient in swollen hydrogel polymeric matrices by means of the inverse sectioning method
1051997Modolo M., Cainelli F., Fermeglia M.1: 1(1997)Third Conference on Chemical and Process Engineering, Firenze, Italy, 1997Modeling and simulation of NOx absorption in pilot-scale packed columns.
971996Fermeglia M., Bertucco A.1: 1(1996)15th European Seminar on Applied Thermodynamics, Liverpool, UK, 1996Thermopysical properties predictions of refrigerant mixtures by a PHST equation of state.
1971996Grassi, M.;Lapasin, R.;Pricl, S.;29:169-181(1996)Carbohydrate PolymersA study of the rheological behavior of scleroglucan weak gel systems
2511996Grassi, M.;Lapasin, R.;Pricl, S.;Colombo, I.;155:89-112(1996)Chemical Engineering CommunicationsApparent non-Fickian release from a scleroglucan gel matrix
4301996Lapasin, R., Grassi, M., Pricl, S.64:99-106(1996)Chemical Engineering Journal and the Biochemical Engineering JournalLink to PDF DocumentRheological modeling of fractal and dense suspensions
991996Fermeglia M., Fele L.www.egc.ac.uk (1996)EGC2 Virtual Conference, Internet, 1997Protein separation by partitioning in poly(ethylene glycol) + dextran + water.
1001996Fermeglia M., Grassi M., Lapasin R., Pricl S.www.egc.ac.uk (1996)EGC2 Virtual Conference, Internet, 1997Swelling proprties of hydrogels: theory in comparison with experiment.
1011996Colombo I., Grassi M., Fermeglia M., Lapasin R., Pricl. S.116: 148-161 (1996)Fluid Phase EquilibriaLink to PDF DocumentModeling phase transitions and sorption desorption kinetics in thermo-sensitive gels for controlled drug delivery systems.
981996De Lorenzi L., Fermeglia M., Torriano G.41: 1121-1125 (1966)Journal of Chemical & Engineering DataLink to PDF DocumentDensity and viscosity of 1-methoxy-2-propanol 2-methyltetrahydrofuran, aaa-trifluorotoluene and their binary mixtures with 1,1,1-trichloroethane at different temperatures.
1021996Fele L., Fermeglia M.41: 331-334 (1996)Journal of Chemical & Engineering DataLink to PDF DocumentPartition of proteins in poly(ethylene glycol) - dextran - water system at 298 K.
2561996Adrover, A.;Giona, M.;Grassi, M.;Lapasin, R.;Pricl, S.;113:7-20(1996)Journal of Membrane ScienceLink to PDF DocumentControlled release of theophylline from water-swollen scleroglucan matrices
961996Donaggio F., Fermeglia M., DeLeeuw V.9: 207-215 (1996)The Journal of Supercritical FluidsLink to PDF DocumentPrediction of high pressure multicomponent phase equilibria using a perturbed hard chain equation of state.
1011996Colombo I., Grassi M., Fermeglia M., Lapasin R., Pricl. S.116: 148-161 (1996)VIIth Int. Conference on 'Fluid Properties and Phase Equilibria for Chemical Process Design', Snowmass, USA, 1995Link to PDF DocumentModeling phase transitions and sorption desorption kinetics in thermo-sensitive gels for controlled drug delivery systems.
931995Donaggio F., Fermeglia M., DeLeeuw V.1: 51-58 (1995)4th conference on 'Supercritical Fluids and their Applications', Grignano, Italy, 1995High pressure multicomponent phase equilibria from a non cubic equation of state.
4331995Lapasin R, De Lorenzi L., Pricl S., Torriano G.28: 195-202 (1995)Carbohydrate PolymersFlow properties of hydroxypropyl guar gum and its long-chain hydrophobic derivatives
941995Fermeglia M.1:1(1995)Impiego dei simulatori nei processi chimici, Padova, Italy, 1995La cristallizzazione nell' industria farmaceutica: simulazione di processo.
4291995De Lorenzi, L., Pricl, S., Torriano, G.5:661-671(1995)International Dairy JournalLink to PDF DocumentRheological behaviour of low-fat and full-fat stirred yoghurt
921995Delorenzi L., Fermeglia M., Torriano G.40: 1172-1177 (1995)Journal of Chemical & Engineering DataLink to PDF DocumentDensities and viscosities of 1,1,1 tricholoroethane with thirteen different solvents at 298.15 K.
2431995Grassi, M.;Lapasin, R.;Pricl, S.;Colombo, I.;1:364-365(1995)Proceedings of the Controlled Release SocietyAnalysis and modeling of release experiments
951995Fermeglia M., Bertucco A.1: 111-116 (1995)Second Conference on Chemical and Process Engineering, Firenze, Italy, 1995Prediction of thermophysical properties of refrigerants.
861994Fermeglia M, DeLeeuw V.1: 79 (1994)14th European Seminar on Applied Thermodynamics, Marathon, Greece, 1994The quality of the prediction of parameters for the NRTL and PHCT methods for thermodynamic property calculation in process simulation.
871994Fermeglia M., Fele L.1: 92 (1994)6th European Symposium on Thermal Analysis and Calorimetry, Grado, Italy, 1994Protein partitions in aqueous two phase systems.
911994Fermeglia M., Kikic I., Reverchon E.8(1): 21-24 (1994)Chem. Biochem. Eng. Q.Thermodynamic behavior of n-alkanes-carbon dioxide systems - solubility in near critical condition.
891994Fele L., Vidali P., Alessi P., Fermeglia M.,49: 3677-3680 (1994)Chemical Eng. ScienceRecovery of n-methylmorpholine from waste aqueous streams by distillation.
881994Delorenzi L., Fermeglia M., Torriano G.39: 483-487 (1994)Journal of Chemical & Engineering DataLink to PDF DocumentDensities and viscosities of 1,1,1 tricholoroethane + paraffins and, + cycloparaffines at 298.15 K.
901994Fele L., Fermeglia M., Alessi P., Rarey J.R., Golob J.39: 735-741 (1994)Journal of Chemical & Engineering DataLink to PDF DocumentVapor-liquid and liquid-liquid equilibria for the toluene + 1,2-propanediol +water system.
4281994Grassi, M., Lapasin, R., Pricl, S., Colombo, I., Adrover, A., Giona, M.1:533-534(1994)Proceedings of the Controlled Release SocietyRelease from a scleroglucan hydrogel matrix
851994Bevilacqua P. and Fermeglia M.1: 358-366 (1994)Regional APCOM Symposium, Bled, Slovenia, 1994Recent developments in the modelling of screening operations.
841994Spicka B., Cortesi A., Fermeglia M., Kikic I.7: 171-176 (1994)The Journal of Supercritical FluidsLink to PDF DocumentDetermination of partial molar volumes at infinite dilution using SFC technique.
821993Fermeglia M., Kikic I., 48: 3889-3896 (1993)Chemical Eng. ScienceLink to PDF DocumentThe perturbed hard chain theory for the prediction of supercritical fluid extraction: binary mixtures.
831993Fele L., Vidali P., Fermeglia M., Alessi P.1:1 (1993)CHISA93, Prague, Czech Rep., 1993Recovery of n-methylmorpholine from waste streams by distillation.
781993Aim K., Fermeglia M.1:1(1993)Czechoslovack-French-Polish Conference on Calorimetry and Experimental Thermodynamics, Prague, Check Rep., 1993Solubilities of solids and liquids in supercritical fluids.
771993Aim K., Fermeglia M.1:1(1993)Euchem Conference on Thermodynamics and Modeling of Separation Processes, Trondheim, Norway, 1993Measurement of the solubility of solids and liquids in supercritical fluids.
761993Fermeglia M., Kikic I.,1: 111-115 (1993)First Conference on Chemical and Process Engineering, Firenze, Italy, 1993The perturbed hard chain theory for the prediction of hydrocarbon mixture properties.
811993Zuliani M., Barreau A., Vidal J., Alessi P., Fermeglia M.,82: 141-148 (1993)Fluid Phase EquilibriaMeaurements, correlation and prediction of Henry's constants of light alkanes in model heavy hydrocarbons and petroleum fractions.
791993Cortesi A., Fermeglia M., Kikic I.,1:1 (1993)II European Symp. On Analytical SFC and Extraction, Riva del Garda. Italy, 1993SFC determination of partial molar volumes.
801993Cortesi A., Fermeglia M., Kikic I.,23: 45-59 (1993)Latin American Applied ResearchA contribution to the thermodynamic of aqueous two phase systems.
811993Zuliani M., Barreau A., Vidal J., Alessi P., Fermeglia M.,82: 141-148 (1993)Vith Int. Conference on 'Fluid Properties and Phase Equilibria for Chemical Process Design', Cortina d'Ampezzo, Italy, 1992Meaurements, correlation and prediction of Henry's constants of light alkanes in model heavy hydrocarbons and petroleum fractions.
4311992Lapasin, R., Pricl, S., Bertocchi, C., Navarini, L., Cesaro, A., De Philippis, R.17:1-10(1992)Carbohydrate PolymersRheology of culture broths and exopolysaccharide of Cyanospira capsulata at different stages of growth
731992Colussi I., Fermeglia M., Gallo V., Kikic I., 16: 211-224 (1992)Computers & Chem.EngLink to PDF DocumentSupercritical multistaged multicomponent separation: process simulation.
2521992Lapasin, Romano;Pricl, Sabrina;Tracanelli, Paolo;46:1713-1722(1992)Journal of Applied Polymer ScienceCarboxymethyl starch: A rheological study
741992Cortesi A., Fermeglia M., Kikic I., Spicka B.,22: 125:133 (1992)Latin American Applied ResearchOn the use of supercritical fluid chromatography for the determination of thermophysical properties.
751992Alessi P., Fermeglia M., Kikic I., Neau E.,5: 151-156 (1992)The Journal of Supercritical FluidsLink to PDF DocumentPhase behavior prediction for binary volatile-nonvolatile mixtures of n.paraffins.
691991Fermeglia M., Kikic I.,1: 147 (1991)1st conference on 'Supercritical Fluids and their Applications', Amalfi, Italy, 1991Calcolo di proprietà volumetriche mediante una equazione di stato PHC.
681991Kikic I., Fermeglia M., 1: 181-187 (1991)2nd Colloque sur Les Fluides Supercritiques, Paris, France, 1991Retention properties in SFC by means of an equation of State.
4321991Lapasin, R., Pricl, S., Tracanelli, P.14:411-427(1991)Carbohydrate PolymersRheology of hydroxyethyl guar gum derivatives
701991Gregorowicz J., Fermeglia M., Soave G., Kikic I., 46: 1427-1436 (1991)Chemical Eng. ScienceLink to PDF DocumentThe perturbed hard chain theory for the prediction of supercritical fluid extraction: pure component properties.
711991Kikic I., Fermeglia M., Rasmussen P., 46: 2775-2780 (1991)Chemical Eng. ScienceLink to PDF DocumentUNIFAC prediction of vapor-liquid equilibria in mixed solvent/salt systems.
721991Genovese F., Fermeglia M., Kikic I.,1: 26 (1991)Convegno di Informatica Chimica, Venezia, Italy, 1991L' interfacciamento di un algoritmo di ottimizzazione con un simulatore di processi chimici.
671991Alessi P., Fermeglia M., Kikic I.,70: 239-250 (1991)Fluid Phase EquilibriaLink to PDF DocumentSignificance of dilute regions.
661990Neau E., Alessi P., Fermeglia M., Kikic I., 45: 795-808 (1990)Chemical Eng. ScienceLink to PDF DocumentLow-pressure equilibrium data for the prediction of solubility in carbon dioxide.
621990Neau E., Rogalsky M., Alessi P., Fermeglia M., 56: 189-202 (1990)Fluid Phase EquilibriaVLE of alkanol-alkane systems with the modified CRG model.
611990Pettenati C., Alessi P., Fermeglia M., Kikic I., 54: 81-91 (1990)Fluid Phase EquilibriaLink to PDF DocumentVapor liquid equilibrium data for systems containing morpholine.
631990Soave G., Fermeglia M., 60: 261-271 (1990)Fluid Phase EquilibriaLink to PDF DocumentOn the application of cubic equations of state to synthetic high-pressure VLE measurements.
641990Kikic I., Alessi P., Fermeglia M., Gregorowicz J., 1: 353-358 (1990)High pressure Chem. Eng. Tech., Erlangen, Germany, 1990High pressure phase equilibria calculations by means of a non cubic equation of state.
651990Pettenati C., Alessi P., Fermeglia M., Kikic I., 162: 203-212 (1990)Thermochimica ActaExcess volumes of binary mixtures containing morpholine.
541989Alessi P., Colussi I., Fermeglia M., Gallo V., Kikic I., 3: 173-179 (1989)Chem. Biochem. Eng. Q.A semibatch supercritical fluid extraction pilot plant and its simulation.
601989Cesari G., Fermeglia M., Kikic I., Policastro M., 13: 1175-1181 (1989)Computers & Chem.EngLink to PDF DocumentA computer program for the dynamic simulation of a semibatch supercritical fluid extraction process.
591989Alessi P., Cortesi A., Fermeglia M., Fontana M., Kikic I., 53: 397-406 (1989)Fluid Phase EquilibriaPrediction of solubility in heavy ends by means of PHCT.
581989Bertucco A., Fermeglia M., Guarise G.B., Kikic I., 25: 22-27 (1989)Ing. Chim. Ital.Analysis of supercritical fluid extraction processes using a microcomputer simulator.
561989Colussi I., Fermeglia M., Gallo V., Kikic I., 1: 97 (1989)IV Int. Conference on Thermodynamics of Solution of non-electrolytes, Santiago de Compostela, Spain, 1989Theoretical evaluation of the performance of a SFE column coupling GCEOS with a rigorous simulation model.
571989Favento F., Fermeglia M., Kikic I., Lapasin R., Torriano G.1: 89 (1989)IV Int. Conference on Thermodynamics of Solution of non-electrolytes, Santiago de Compostela, Spain, 1989On the application of the group contribution concept to mixture viscosity calculation.
551989Fermeglia M., Lapasin R., Torriano G., 35: 260-265 (1990)Journal of Chemical & Engineering DataExcess volumes and viscosities of binary systems containing 4-methyl-2-pentanone.
531989Alessi P., Fermeglia M., Kikic I., 34: 236-240 (1989)Journal of Chemical & Engineering DataLink to PDF DocumentLiquid liquid equilibrium of cyclohexane - n-hexane - methanol mixtures: effect of water content.
591989Alessi P., Cortesi A., Fermeglia M., Fontana M., Kikic I., 53: 397-406 (1989)Vth Int. Conference on 'Fluid Properties and Phase Equilibria for Chemical Process Design', Banff, Canada, 1989Prediction of solubility in heavy ends by means of PHCT.
501988Alessi P., Fermeglia M., Kikic I., 43: 355-358 (1988)Fluid Phase EquilibriaLimitations of differential static apparatus in dilute regions.
511988Alessi P., Fermeglia M., Kikic I., Soave G., 42: 173-183 (1988)Fluid Phase EquilibriaLink to PDF DocumentOn the application of solution of group theory to dilute mixtures of isomers.
451988Alessi P., Fermeglia M., Kikic I., Neau E., Peneloux A., 1: 125-135 (1988)Int. Symp. On Supercritical Fluids, Nice, France, 1988Solubility in dense gases from Henry's constants.
471988Alessi P., Fermeglia M., Kikic I., Neau E.,2: 569-581 (1988)Int. Symp. On Thermodynamics in Chem. Eng. And Industry, Beijing, China, 1988Calculation of solubility in condensed gases: light hydrocarbons.
481988Colussi I., Fermeglia M., Gallo V., Kikic I., 1: 300-312 (1988)Int. Symp. On Thermodynamics in Chem. Eng. And Industry, Beijing, China, 1988Aspects of modelling electrolyte solutions.
461988Fermeglia M., Lapasin R., 33: 415-417 (1988)Journal of Chemical & Engineering DataLink to PDF DocumentExcess volumes and viscosities of binary mixtures of organics.
491988Fermeglia M., Kikic I., Lapasin R., Torriano G., 1:1 (1988)Stampato in proprioOn the application of thermodynamic models to mixture viscosity calculation.
521988Alessi P., Bertucco A., Fermeglia M., 137: 21-38 (1988)Thermochimica ActaCorrelation of thermodynamic properties of fluids by means of equations of state.
431987Colussi I., Fermeglia M., Gallo V., 2: 629-630 (1987)4th Mediter. Congress on Chem.Eng., Barcelona, Spain, 1987A decision making software for the calculation of multistage separation processes.
391987Alessi P., Fermeglia M., Kikic I., 1: 447-452 (1987)CEF 87: The use of computer in chemical engineering, Giardini Naxos, Italy, 1987Properties in the dilute region for the design of separation processes.
401987Colussi I., Fermeglia M., Gallo V., Kikic I., 1: 785-790 (1987)CEF 87: The use of computer in chemical engineering, Giardini Naxos, Italy, 1987Modeling a multistage supercritical fluid extraction.
441987Fermeglia M., Mollerup J., 1: 95-100 (1987)Chem. Biochem. Eng. Q.Pure component vapour pressures by means of a hard sphere equation of state.
411987Alessi P., Fermeglia M., Kikic I., Soave G., B: 381-389 (1987)Ind. Chem. Eng. Symp. Ser. No 104, Brighton, UK, 1987On the use of infinite dilution activity coefficients in equations of state.
421987Alessi P., Fermeglia M., Kikic I.,1: 201-212 (1987)Int. Symp. On Supercritical Fluids, Pont a Mousson, France, 1987On the feasibility of separation of fatty acids from natural products.
321986Kikic I., Alessi P., Bugarin R., Fermeglia M., 1: 1-13 (1986)EFCE: Working party on Distillation, Amsterdam, The Netherlands, 1986Recovery of methanol from water formaldehyde containing streams.
361986Alessi P., Fermeglia M., Kikic I.,27: 93-102 (1986)Fluid Phase EquilibriaLink to PDF DocumentCorrelation of 1-alkanol - n-alkane activity coefficients at infinite dilution by means of GCEOS equation.
381986Alessi P., Fermeglia M., Kikic I., 29: 249-256 (1986)Fluid Phase EquilibriaLink to PDF DocumentA differential static apparatus for the investigation of the infinitely diluted region.
331986Alessi P., Fermeglia M., Gallo V., Kikic I., 3: 715-722 (1986)International Solvent Extraction Conference - ISEC86, Munchen, Germany, 1986Evaluation of the solubility of organic compounds in supercritical fluids.
371986Bertucco A., Fermeglia M., Kikic I., 32: 21-30 (1986)The Chemical Engineering JournalLink to PDF DocumentModified Carnahan - Starling - Van der Waals equation for supercritical fluid extraction.
291986Bertucco A., De Amicis A., Fermeglia M., Gallo V., Kikic I.,1: 243-250 (1986)The Fifth Austrian- Italian-Yugoslav Chemical Engineering Conference, Portoroz, Yugoslavia, 1986Phase equilibria and transport properties in the simulation of a supercritical fluid extraction process.
301986Alessi P., Fermeglia M., Kikic I.,1: 99-106 (1986)The Fifth Austrian- Italian-Yugoslav Chemical Engineering Conference, Portoroz, Yugoslavia, 1986State of the art on infinite dilution activity coefficients.
311986Kikic I., Alessi P., Bugarin R., Fermeglia M., 1: 209-216 (1986)The Fifth Austrian- Italian-Yugoslav Chemical Engineering Conference, Portoroz, Yugoslavia, 1986Separation of methanol from aqueous solutions of formaldehyde.
341986Alessi P., Bugarin R., Fermeglia M., Kikic I., 2: 164-167 (1986)World Congress III of Chemical Engineering, Tokyo, Japan, 1986Thermodynamics of water formaldehyde system.
351986Alessi P., Cimino R., Fermeglia M., Gallo V., Kikic I., 3: 1032-1035 (1986)World Congress III of Chemical Engineering, Tokyo, Japan, 1986Evaluation of the solubility of fatty acids in supercritical fluids.
281985Preti U., Colussi I., Fermeglia M., Gallo V., Groppi G., Kikic I., Pomodoro C., Schmid C.1: 314-338 (1985)In "Synthesis of the results of the II RD programme", Published by CEE, Brussels, ISBN 92-825-5270-5The feasibility of integrating thermochemical process for the decomposition of water in coal gassification.
241985Bertucco A., Fermeglia M., Guarise G.B., Kikic I., 21: 45-57 (1985)Ing. Chim. Ital.Estrazione con solventi supercritici: problemi fondamentali e di processo.
251985Alessi P., Fermeglia M., Kikic I., 10: 1-9 (1985)IV Int. Chem. Eng. Conference CHEMPOR85, Coimbra, Portugal, 1985Thermal properties of binary mixtures at infinite dilution.
261985Fermeglia M., 1: 147-149 (1985)ProximaBanche dati di proprietà chimico fisiche: un esempio di struttura di banche dati numeriche.
221985Kikic I., Alessi P., Fermeglia M., 1: 117-125 (1985)The Second International IUPAC workshop on VLE in 1 alkanol + n alkane mixtures, Paris, France, 1985What is the meaning of infinite dilution.
231985Alessi P., Fermeglia M., Kikic I1: 68-73 (1985)The Second International IUPAC workshop on VLE in 1 alkanol + n alkane mixtures, Paris, France, 1985Activity coefficients at infinite dilution for 1-alkanol n-alkane systems: measurement and correlation.
271985Kikic I., Alessi P., Fermeglia M., 1: 160 (1985)VII AICAT-AFCAT, Montpellier, France, 1985Thermal effects in the diluted region.
131984Kikic I., Alessi P., Fermeglia M., 1: 125-131 (1984)3rd International Conference on Thermodynamics of Solutions of non-Electrolytes, Clermont FD, France, 1984Limiting activity coefficient data collection.
211984Alessi P., Kikic I., Fermeglia M., Nonino C.18: 93-102 (1984)Fluid Phase EquilibriaLink to PDF DocumentLiquid - liquid equilibrium data for ternary systems containing organic acid, hydrocarbon and water.
201984Fermeglia M., Kikic I., 29: 687-695 (1984)Journal of Thermal AnalysisExcess enthalpy calculations by means of equations of state.
141984Fermeglia M., Mollerup J., SEP8422: 1-19 (1984)SEP - University of LyngbyVapour - liquid equilibrium by means of a modified Carnahan - Starling - Van der Waals equation of state.
151984Kikic I., Alessi P., Fermeglia M., 2: 619-624 (1984)The Fourth Austrian- Italian-Yugoslav Chemical Engineering Conference, Grado, Italy, 1984Calculation of ternary liquid-liquid equilibria from binary information.
161984Alessi P., Fermeglia M., Kikic I.,2: 939-948 (1984)The Fourth Austrian- Italian-Yugoslav Chemical Engineering Conference, Grado, Italy, 1984Thermodynamic properties from infinite dilution data by means of equations of state.
171984Fermeglia M., Kikic I., Preti U., 2: 905-915 (1984)The Fourth Austrian- Italian-Yugoslav Chemical Engineering Conference, Grado, Italy, 1984Dual column separation processes: recovery of bromine from hydrobromic acid containing streams.
181984Kikic I., Alessi P., Fermeglia M.2: 922-929 (1984)The Fourth Austrian- Italian-Yugoslav Chemical Engineering Conference, Grado, Italy, 1984Activity coefficients at infinite dilution data bank
191984Alessi P., Fermeglia M., Inchingolo P., Kikic I., Mumolo E., Pantani F., 1: 862-873 (1984)The Fourth Austrian- Italian-Yugoslav Chemical Engineering Conference, Grado, Italy, 1984Thermodynamic properties by GLC: real time determination by a microcomputer based system.
81983Alessandrini A., Alessi P., Fermeglia M., Kikic I., Lapasin R., 1: 367-372 (1983)Convegno GRICU, Milano, Italy, 1983Determinazione e correlazione di dati di equilibrio tra fasi fluide.
91983Kikic I., Alessi P., Fermeglia M., 14: 363-372 (1983)Fluid Phase EquilibriaPrediction of finite concentration behavior from infinite dilution equilibrium data.
91983Kikic I., Alessi P., Fermeglia M., 14: 363-372 (1983)III Int. Conference on 'Fluid Properties and Phase Equilibria for Chemical Process Design', Callaway Garden, USA, 1983Prediction of finite concentration behavior from infinite dilution equilibrium data.
101983Kikic I., Alessi P., Lapasin R., Fermeglia M., 1: 544-545 (1983)International Solvent Extraction Conference - ISEC83, Denver, US, 1983Prediction of ternary liquid - liquid equlibria.
111983Fermeglia M., SEP8317: 1-18 (1983)SEP - University of LyngbyVapour - liquid and gas solubility calculations by means of the UNIQUAC equation of state.
121983Orlandini M., Fermeglia M., Kikic I., Alessi P., 26: 245-250 (1983)The Chemical Engineering JournalLiquid - liquid equilibria for water - propanol and water - butanol - chlorocompound systems.
71982Alessi P., Kikic I., Alessandrini A., Fermeglia M.,27: 445-448 (1982)Journal of Chemical & Engineering DataLink to PDF DocumentActivity coefficients at infinite dilution by gas-liquid chromatograpy. 1. Hydrocarbons and n-chloroparaffines in organic solvents.
41982Alessandrini A., Alessi P., Fermeglia M., Kikic I., 1: 230-237 (1982)The Third Austrian- Italian-Yugoslav Chemical Engineering Conference, Graz, Austria, 1982Activity coefficients at infinite dilution: package programs.
51982Fermeglia M., Kikic I., Lapasin R.1: 98-105 (1982)The Third Austrian- Italian-Yugoslav Chemical Engineering Conference, Graz, Austria, 1982Comparison between different models for excess free energy.
61982Orlandini M., Fermeglia M., 1: 138-144 (1982)The Third Austrian- Italian-Yugoslav Chemical Engineering Conference, Graz, Austria, 1982Liquid-liquid equilibrium for ternary systems water - alcohol - chlorocompounds.
31981Cressi E., Fermeglia M., Alessi P., Kikic I.,112: 1-27 (1981)Ist. Chim. Appl. e Ind. - Università di TriesteCostanti di Henry: rassegna bibliografica.
21980Kikic I, Alessi P., Fermeglia M., Nonino C.1: 44-50 (1980)The Second Austrian- Italian-Yugoslav Chemical Engineering Conference, Bled, Yugoslavia, 1980Different approaches for the evaluation of equilibrium data in solvent extraction processes.
11980Fermeglia M., Nonino C., Kikic I., Alessi P., 5: 1-11 (1980)The Second Austrian- Italian-Yugoslav Chemical Engineering Conference, Bled, Yugoslavia, 1980Link to PDF DocumentEquilibrio liquido-liquido in sistemi ternari contenenti acidi organici.
11980Fermeglia M., Nonino C., Kikic I., Alessi P., 5: 1-11 (1980)Università di Udine - Collana internaLink to PDF DocumentEquilibrio liquido-liquido in sistemi ternari contenenti acidi organici.