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General information

Program of the 14 September 2018

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Former workshop: 2003 2004 2006 2007 2009 2011 2012 2013 2014 2015 2016


Dr Luc Patiny
BCH 5121
CH-1015 Lausanne
Tel. : +41 21 693 94 69
Fax. : +41 21 693 93 55

luc.patiny at epfl.ch

Workshop on Chemical Information

30 June 2006 - CHB.3.31

10h30 ISIDA Reac. Frank Hoonakker (Université Louis Pasteur, Strassbourg)
10h50 Quest for the Rings – In Silico Exploration of Ring Universe to Identify Novel Bioactive Heteroaromatic Scaffolds. Peter Ertl (Novartis, Basel)
11h10 The Chemical Universe of Small Molecules: Generation, Analysis,
Application. Tobias Fink (University of Berne)
11h30 Virtual screening of the small-molecule chemical universe database for NMDA
receptor ligands. Kong Thong Nguyen (University of Berne)
12h00-14h00 Lunch
14h00 Scientific Grid Computing Infrastructure. Christian Rufener (Actelion, Basel)
14h15 3D-Pharmacophores for ligand based screening. Modest vonKorff (Actelion, Basel)
14h35 A docking tool in practice. Joel Freyss (Actelion, Basel)
14h50 Binary SOMs for Compound Clustering. Thomas Sander (Actelion, Basel)
15h10 Coffee break
15h40 Assay Designer. Damiano Banfi (EPFL, Lausanne)
16h00 www.nmrdb.org - Tools for NMR spectra. Luc Patiny (EPFL, Lausanne)
16h20-17h00 Round table about the chemical information and shared interests of the attendees.
Aperitif and dinner

©2004 EPFL, 1015 Lausanne, tel. +41 21 693 94 69, luc.patiny at epfl.ch