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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?
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
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
4502010Fermeglia M., Pricl S.Conference CDEMCC6 - European Medirranean Chemical Engineering Conference, Antalya, TurkeyMultiscale molecular modeling for nanostructured hybrid inorganic/organic materials
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
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
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
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
3902008Fermeglia M., Pricl S.25:725-1(2008)18th ESCAPE, Lyon, FMultiscale molecular modeling: a tool for the design of nano structured materials
3912008Fermeglia M., Pricl S.CD (2008)5th Chemcial engineering conference for Collaborative research in eastern Mediterranean Countries EMCC5Multiscale molecular modeling for nanostructured materials
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
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
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
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
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
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
3252007Fermeglia M., Pricl S.58:187-199 (2007)Coating Science International - COSI 2006Link to PDF DocumentMultiscale modeling for polymer systems of industrial interest
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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.
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
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.
1592001M. Fermeglia, S. Pricl, D. SulliniAIChE national meeting 2001, Rino, USALink to PDF DocumentPhase equilibria prediction by molecular simulations: comparison of different methods
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
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
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
1522000Fermeglia M., Ferrone M., Pricl M.1: 80 (2000)AIChE national meeting 2000, Los Angeles, USALink to PDF DocumentMolecular Simulation of dendrimeric Porphyrins
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
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
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.
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.
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.
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.
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.
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.
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.
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.
1141998Fermeglia M., Pricl S.1: 415 (1998)GRICU conference, Ferrara, Italy, 1998Calcolo di proprietà termofisiche mediante esperimenti virtuali: applicazione a fluidi refrigeranti e polimeri.
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.
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)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.