| COMP | Wednesday, 31 August 2005 | ||
8:10 AM-12:05 PM Washington DC Convention Center -- 151A, Oral | |||
Visualization and Interpretation of Computational Models | |||
| Organizers: | Anton Filikov Rocio Palma | ||
| Organizer, Presiding: | Andrew Smellie | ||
| 8:10 AM | Introductory Remarks | ||
| 8:20 AM | 248 | Visualizing structure-activity relationships in ABCD Dimitris K. Agrafiotis | |
| 8:50 AM | 249 | Molecular Property eXplorer: A novel approach to visualizing SAR Christopher Kibbey | |
| 9:20 AM | 250 | SAESAR: Software workbench for the interpretation and visualization of shape, electrostatics and structure activity relationships Norah E. MacCuish, Anthony Nicholls, John D. MacCuish, Mitch Chapman | |
| 9:50 AM | Intermission | ||
| 10:05 AM | 251 | Sherloque: A general purpose SAR and property viewer Andrew Smellie | |
| 10:35 AM | 252 | Cassandra: A web interactive molecular modeling and cheminformatics visualization interface Lewis Whitehead, Peter Gedeck, Wendy D. Cornell, Peter Finan | |
| 11:05 AM | 253 | Use of Spotfire™ profile charts to display dose-response curves for comparison of compounds' in vitro transcriptional activities Daniel R. McMasters, J. Christopher Culberson | |
| 11:35 AM | 254 | PyMOL: A communications tool for computational models Warren L DeLano, Joni W Lam | |
Visualization and Interpretation of Computational Models -- Next Session
Symposium Grid -- Division of Computers in Chemistry -- Session Listing
The 230th ACS National Meeting, in Washington, DC, Aug 28-Sept 1, 2005