Session Index
Session S5: Quantum Mechanics/Molecular Mechanics: Developments and Applications |
Show Abstracts |
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Sponsoring Units: DBP Chair: Victor Batista, Yale University Room: Colorado Convention Center Korbel 1A-1B |
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Wednesday, March 7, 2007 2:30PM - 3:06PM |
S5.00001: Modeling Enzymatic Reactions in Proteins. Invited Speaker: Richard Friesner Preview Abstract |
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Wednesday, March 7, 2007 3:06PM - 3:42PM |
S5.00002: Challenges and advances in QM/MM methods for studies of energetics and dynamics of biological systems Invited Speaker: Arieh Warshel Preview Abstract |
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Wednesday, March 7, 2007 3:42PM - 4:18PM |
S5.00003: QM/MM in complex systems using SCC-DFTB and its implementation in Amber. Invited Speaker: Adrian Roitberg Preview Abstract |
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Wednesday, March 7, 2007 4:18PM - 4:54PM |
S5.00004: Improved QM Methods and Their Application in QM/MM Studies of Enzymatic Reactions Invited Speaker: William L. Jorgensen Preview Abstract |
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Wednesday, March 7, 2007 4:54PM - 5:30PM |
S5.00005: Local and global refinement of electronic and structural properties of proteins via QM/MM Invited Speaker: Jose Gascon Preview Abstract |