| COMP | Monday, 27 March 2006 | ||
1:30 PM-5:15 PM Georgia World Congress Center -- B305, Oral | |||
Virtual Screening Using Structure-based and Ligand-based Methods for Lead Identification | |||
| Organizers: | Lakshmi Narasimhan Leslie A. Kuhn Wan Lau | ||
| 1:30 PM | 76 | Progress in Computer-Aided Drug Design William L. Jorgensen | |
| 2:00 PM | 77 | BACE: Accounting for flexibility in a scoring Function Georgia McGaughey, Bradley Feuston, Samuel Graham, M. Katherine Holloway, Stacey Lindsley, Philippe Nantermet, Hemaka Rajapakse, Shaun Stauffer | |
| 2:30 PM | 78 | Pharmacophore-based virtual screening John Van Drie | |
| 3:00 PM | Intermission | ||
| 3:15 PM | 79 | A comparison of structure-based and shape-based tools for virtual screening Paul Hawkins | |
| 3:45 PM | 80 | PubChem: An information resource linking chemistry and biology Stephen Bryant | |
| 4:15 PM | 81 | Beyond PEST descriptors: Binding site and ligand shape/property fingerprints Curt M. Breneman, Matthew C. Sundling, N. Sukumar, Kristin P. Bennett, Mark J. Embrechts, Steven Cramer | |
| 4:45 PM | Panel Discussion | ||
Previous Session -- Virtual Screening Using Structure-based and Ligand-based Methods for Lead Identification
Symposium Grid -- Division of Computers in Chemistry -- Session Listing
Symposium Grid -- Drug Discovery -- Session Listing
The 231st ACS National Meeting, Atlanta, GA, March 26-30, 2006