COMPWednesday, August 22, 2007

9:00 AM-11:55 AM BCEC -- 156B, Oral
Current Techniques in Molecular Simulation of Biological Systems
Organizers:Nitin Rathore
Thomas A. Knotts IV
9:00 AMContinuum solvents in polarizable force fields: A Poisson-Boltzmann approach
Ray Luo
9:20 AMEfficient dynamic boundary solvation models for biomolecular simulations
Wusheng Zhu, Goran Krilov
9:40 AMFast polarizable force field for molecular simulations
George A. Kaminski
10:00 AMClassical CHARMM Drude oscillator polarizable force field for nucleic acid bases
Victor M. Anisimov, Pedro E. M. Lopes, Alexander D. MacKerell Jr.
10:20 AMIntermission
10:35 AMUnraveling the behavior of DNA through multiscale modeling
Thomas A. Knotts IV, Stephan Deublein, Juan J. de Pablo
10:55 AMMultiproperty parametrization of a coarse grained model for proteins
Russell DeVane, Wataru Shinoda, Michael L. Klein
11:15 AMMolecular simulation of supported lipid bilayers on a coarse grained level
Chenyue Xing, Roland Faller
11:35 AMImplicit modeling of membranes: How much physics can we incorporate?
Michael Feig

Current Techniques in Molecular Simulation of Biological Systems -- Next Session

Symposium Grid -- Division of Computers in Chemistry -- Session Listing

Symposium Grid -- Chemistry of Systems Biology -- Session Listing

The 234th ACS National Meeting, Boston, MA, August 19-23, 2007