Preliminary Program subject to change
Molecular Modeling Throughout the Drug Discovery Process I
Presentation TypeOral
Summary Statement
Presider:Wendy D. Cornell, Merck & Co., Rahway, NJ
Introductory Remarks
Protein Ensemble Docking: A Robust, General Strategy for Greatly Enhanced Lead Docking
Daniel L. Cheney and Luciano Mueller, Bristol-Myers Squibb PRI, Hopewell, NJ
Critical Assessment of Docking Programs and Scoring Functions
Greg Warren, GlaxoSmithKline Pharmaceuticals, Collegeville, PA
Intermission
Rapid and Accurate Protein Side-Chain Prediction
Michael Bower, Incyte Pharmaceuticals, Wilmington, DE
An Ab Initio Method for Predicting the Stereochemistry of Drug Intermediates Using NMR
Keith W. Wiitala, Christopher J. Cramer and Thomas R. Hoye, University of Minnesota, Minneapolis, MN

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