COMPMonday, 29 August 2005

1:15 PM-4:50 PM Washington DC Convention Center -- 150B, Oral
Large Scale Molecular Dynamics, Nanoscale, and Mesoscale Modeling and Simulation: Bridging the Gap
Biological Applications and Multi-Scaling Methodologies
Organizers:Richard B. Ross
Sanat Mohanty
Presiding:Gustavo A. Carri
1:15 PMIntroductory Remarks
1:20 PMSymmetry, form and shape: Guiding principles for robustness in macromolecular machines
Charles L. Brooks III, Florence Tama
2:00 PMMixed level coarse-graining of protein structures for dynamics
RL. Jernigan, Pemra Doruker
2:40 PMThe multi-scale simulation of biomolecular assemblies
Gregory A. Voth
3:20 PMIntermission
3:30 PMSimulating, modeling and refining supramolecular complexes at multi-resolution and multi-length scales
Jianpeng Ma
4:10 PMCoarse grained to atomistic mapping algorithm: A tool for multiscale simulations
Steven O. Nielsen, Michael L. Klein

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The 230th ACS National Meeting, in Washington, DC, Aug 28-Sept 1, 2005