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Lectures

  • Pedretti A., Vistoli G., Mazzolari A., Testa B., "Prediction of metabolite toxicity by meta-analysis", XIII National Meeting in Medicinal Chemistry, Salerno, September 6-9 , 2015.
    Abstract (PDF format)
     
  • Pedretti A., Vistoli G., "Virtual screening and collaborative computing: a new frontier in drug discovery", XI Congreso Venezolano de Química, Carcas (Venezuela), June 16-20, 2013.
    Abstract (PDF format)
    Presentation (PowerPoint format)
     
  • Pedretti A., Vistoli G., "WarpEngine: a new distributed paradigm for parallel computing", Compuatationally Driven Drug Discovery Meeting, Genova, February 4-6, 2013.
    Abstract (PDF format)
    Presentation (PowerPoint format)
     
  • Pedretti A., Vistoli G., Testa B., "MetaPies, an annotated database for metabolism analysis and prediction: results and future perspectives", Compuatationally Driven Drug Discovery Meeting, L'Aquila, November 21-23, 2011.
    Abstract (PDF format)
    Presentation (PowerPoint format)
     
  • Pedretti A., Labozzetta A., Beccari A.R., Moriconi A., Vistoli G., "Exploring the interaction capacities of TRPM8 channel by docking analyses and MD simulations", XXIV Congresso Nazionale della Società Chimica Italiana, Lecce, September 11-16, 2011.
    Abstract (PDF format)
    Presentation (PowerPoint zipped format)
       
  • Pedretti A., Mazzolari A, Vistoli G., "La modellistica molecolare come strumento per la progettazione di molecole bioattive", Dottorato internazionale di ricerca in cellule staminali, Scuola Superiore di Catania, Catania, July, 1, 2010.
     Presentation (PowerPoint zipped format) 
     
  • Pedretti A., Vistoli G., "Protein modelling by fragmental approach: connecting global homologies with local peculiarities", 47th Meeting of Serbian Chemical Society, Belgrade (Serbia), March 21, 2009.
     Abstract (PDF format) 
     Presentation (PowerPoint format) 
     
  • Vistoli G., Pedretti A., Mazzolari A., Testa B., "In silico prediction of metabolism by human carboxylesterase-1 (hCES1) combining docking analyses and MD simulations", logP 2009 - PhysChem and ADMET profiling in drug research, Zurich (Switerland), February 8-11, 2009.
     Abstract (PDF format) 
     
  • Pedretti A., Marconi C., Vistoli G., "GriDock: An MPI-based software for virtual screening in drug discovery", Grid OpenDays on "New frontiers in Drug Discovery: Models & Grid Computing", Catania (Italy), January 22-23, 2009.
     Mini abstract (PDF format) 
     Presentation (PowerPoint format) 
     
  • Pedretti A., Mazzolari A., Vistoli G., "VEGA ZZ: a versatile toolkit for drug design and protein modelling", II Congreso de Fisicoquímica Teórica y Computacional, Choronì - Aragua (Venezuela), December 2-4, 2008.
     Abstract (PDF format) 
     Presentation (PowerPoint format) 
     
  • Vistoli G., "From drug design to drug delivery: new opportunities from molecular modeling", 2nd AItUN Annual Meeting, Perugia (Italy), March 7-8, 2008.
     
  • Vistoli G., De Luca L., Pedretti A., "Modeling of human glutamate transporter EAAT1 using a fragmental approach and Analysis of its interaction capacities through molecular docking and pharmacophore mapping", XVIII Convegno Nazionale della Divisione di Chimica Farmaceutica della Società Chimica Italiana, Chieti-Pescara (Italy), September 16-20, 2007.
     
  • Vistoli G.“Modeling of GPCR proteins using a novel fragmental approach: the enigmatic case of human ghrelin receptor”, European Network Of Doctoral Studies in Pharmaceutical Sciences, Catania (Italy), November 2-4, 2006.
     
  • Pedretti A., Vistoli G., “Modelling the folding of transmembrane proteins using a novel fragmental approach: the human ghrelin receptor and the glutamate transporter EAAT1”, Euro QSAR2006, Civitavecchia (Italy), September 10-17, 2006.
     Abstract (PDF format) 
     Presentation (PowerPoint format) 
     
  • Vistoli G., “Molecular Fields to assess recognition forces”, Solvay Pharmaceutical Conference: Virtual ADMET Assessment in Target Selection and Maturation, Lucerne (Switzerland), May 11-13, 2005.
     
  • Vistoli G., “Dynamic symulations of homology modelled proteins: Fertile or futile ?", Computational methods in drug design, Riva San Vitale (Switzerland), April 3-6, 2005.
     
  • Vistoli G., Pedretti A., Villa L., Testa B., “The concept of the lipophilicity space: the case of acetylcholine”, Complexity in the Living: a problem-oriented approach, Roma (Italy), September 28-30, 2004.
     
  • Vistoli G., Pedretti A., Villa L., Testa B., “RANge & SENsibilità (RANSEN): un nuovo approccio per indagare il concetto di spazio delle proprietà nell’analisi QSAR dinamica”, XVII Convegno Nazionale della Divisione di Chimica Farmaceutica della Società Chimica Italiana, Pisa (Italy), September 6-10, 2004.
     
  • Vistoli G., Pedretti A., Villa L., Testa B., "The concept of Lipophilicity Space", LogP 2004: The 3rd Lipophilicity Symposium - Physicochemical and Biological Profiling in Drug Research, Zurich (Switzerland), February 29 - March 4, 2004.
     
  • Bianchi D., Bolchi C., Di Pumpo R., Fumagalli L., Pallavicini M., Pedretti A., Valoti E., Villa L.,  Vistoli G., “Progettazione e sintesi di inibitori non tiolici della FarnesilTransferasi”, XVI Convegno Nazionale della Divisione Italiana di Chimica Farmaceutica, Sorrento (Italy), September 18-22, 2002.