Thursday, 1 June 2006: 2:00 PM-5:00 PM
Regency Ballroom A (Hyatt Regency Milwaukee)
Computational Chemistry (COMP)
In Silico Approaches in Drug Discovery II: Invited and Contributed Papers
Organizers:Luke Fisher
Shikha Varma-O'Brien
Presiders:Luke Fisher
Shikha Varma-O'Brien
2:00 PMMI-QSAR Analysis as a Computational ADMET Tool
Anton J. Hopfinger
2:40 PMA combined approach to drug metabolism and toxicity assessment
Sean Ekins
3:20 PMBreak
3:40 PMNew classification and regression models for CYP2D6 inhibition and hERG
Leo W. Collins, Yann M. Bidault
4:00 PMIn silico screening of amine libraries for CYP 2D6 (cytochrome P450 2D6)
Aurora D. Costache, Daniel Sem
4:20 PMKnowledge-based approach for hot spot predictions
Steven J. Darnell, David Page, Julie C. Mitchell
4:40 PMComputational exploration of Histone Deacetylase Class I isozymes
Emilio Xavier Esposito, Gregory R. Cook

Back to The 37th Great Lakes Regional Meeting (May 31- June 2, 2006)