| COMP | Tuesday, March 27, 2007 | ||
6:00 PM-8:00 PM Sheraton Chicago -- River Exhibit Hall, Poster | |||
Chemical Computing Group Graduate Student Excellence Award | |||
| Sponsored by: | COMP | ||
| Organizer: | Andrew C. Good | ||
| 232 | Neural network and ab initio studies of metal hydride nanoparticles William Orson Griffin, Jerry A. Darsey | ||
| 233 | Externally corrected coupled-cluster methods employing method of moments of coupled-cluster equations and multi-reference perturbation theory Maricris D. Lodriguito, Piotr Piecuch | ||
| 234 | Molecular dynamic simulations help capture TB-drug-design's most wanted: Mechanism of active site loop ordering Salma Banu Rafi, Kun Song, Todd J. Sullivan, Caroline Kisker, Peter J. Tonge, Carlos Simmerling | ||
| 235 | Electron-phonon coupling in organic semiconductors: A DFT-based approach Roel S. Sánchez-Carrera, Veaceslav Coropceanu, Pavel Paramonov, Jean-Luc Brédas | ||
| 236 | Monte Carlo investigations of fundamental properties of organic molecules in the gas and liquid phases Laura L. Thomas, Theodore J. Christakis, William L. Jorgensen | ||
Symposium Grid -- Division of Computers in Chemistry -- Session Listing
The 233rd ACS National Meeting, Chicago, IL, March 25-29, 2007