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Molecular-Dynamics Simulations of ELIC - a Prokaryotic Homologue of the Nicotinic Acetylcholine Receptor.
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Oct 01, 2009 |
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Water Molecules in Short- and Long-Distance Proton Transfer Steps of Bacteriorhodopsin Proton Pumping.
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Oct 01, 2009 |
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A Peptide-Linkage Deletion Procedure for Estimate of Energetic Contributions of Individual Peptide Groups in a Complex Environment: Application to Parallel β-Sheets
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Oct 01, 2009 |
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The QM/MM Molecular Dynamics and Free Energy Simulations of the Acylation Reaction Catalyzed by the Serine-Carboxyl Peptidase Kumamolisin-As.
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Oct 01, 2009 |
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Determinants of Catalytic Power and Ligand Binding in Glutamate Racemase.
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Oct 01, 2009 |
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Scaling of Multimillion-Atom MD Simulation on Petascale Supercomputers
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Xiaohu Hu
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Nikolai Smolin, Ph.D.
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Cellobiohydrolase
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Jaguar Supercomputer
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Performance RF
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Sunsphere
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Sep 30, 2009 |
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Smokey Mountains
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Sep 30, 2009 |
| Inbook Reference |
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Oct 01, 2009 |
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Transition Networks: A Unifying Theme for Molecular Simulation and Computer Science
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Oct 01, 2009 |
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Transition Networks: A Unifying Theme for Molecular Simulation and Computer Science
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May 06, 2009 |
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Choosing an Appropriate Water Model for Use in Biomolecular Simulations
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Oct 01, 2009 |
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Choosing an Appropriate Water Model for Use in Biomolecular Simulations
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Two students at Molecular Kinetics 2009
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Planting seeds to unlock thorny ethanol enigma
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