| COMP | Tuesday, August 21, 2007 | ||
1:00 PM-5:15 PM BCEC -- 156B, Oral | |||
Computational Science & Engineering Advances Supported by NSF Resource | |||
| Molecular Sciences | |||
| Organizer: | John Towns | ||
| 1:00 PM | 255 | From megaflops to teraflops: From molecules to cells Klaus Schulten | |
| 1:30 PM | 256 | Classical and quantum/classical biological modeling using the TeraGrid Adrian E Roitberg | |
| 2:00 PM | 257 | Biomolecular simulation toward the petascale: Performance, workflow, and application to nucleic acid structure and dynamics Thomas E. Cheatham III | |
| 2:30 PM | 258 | Multi-terascale molecular modeling of biological systems Russell DeVane, Wataru Shinoda, Jerome Henin, Matteo Dal Peraro, Axel Kohlmeyer, Michael L. Klein | |
| 3:00 PM | Intermission | ||
| 3:15 PM | 259 | Using NSF supercomputer resources to study biomolecular structure and function Jeffry D. Madura | |
| 3:45 PM | 260 | New discoveries in biomolecular systems enabled by high performance computing Gregory A. Voth | |
| 4:15 PM | 261 | Using large-scale computing to investigate dynamic aspects of biomolecular structure and function Carlos L Simmerling | |
| 4:45 PM | 262 | Integrated computational biology: From the molecule to the cell J Andrew McCammon | |
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The 234th ACS National Meeting, Boston, MA, August 19-23, 2007