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The top documents tagged [dispersion interactions]
A coupled (hybrid) potential QM/MM/MD simulations in Amber Dr. Vladislav Vasilyev Supercomputer Facility The Australian National University
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Spray Training
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Molecular Modeling Using HPC and Gaussian: Density-Functional Theory and Noncovalent Interactions Gino A. DiLabio National Institute for Nanotechnology
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Vallico Sotto July 20091 Bartolomeo Civalleri Theoretical Chemistry Group Department of Chemistry IFM & NIS Centre of Excellence University of Torino
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1.Solvation Models and 2. Combined QM / MM Methods See review article on Solvation by Cramer and Truhlar: Chem. Rev. 99, 2161-2200 (1999)
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Institute for Plasma Physics Rijnhuizen PROTON TRANSFER IN NEUTRAL PEPTIDES EXAMINED BY CONFORMATIONAL SPECIFIC IR/UV SPECTROSCOPY Sander Jaeqx 67 th International
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Jason Crain School of Physics, University of Edinburgh, Edinburgh UK
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THE MICROWAVE STUDIES OF GUAIACOL (2-METHOXYPHENOL), ITS ISOTOPOLOGUES & VAN DER WAALS COMPLEXES Ranil M. Gurusinghe, Ashley Fox and Michael J. Tubergen,
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Solvation Models and 2. Combined QM / MM Methods
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Molecular Modeling Using HPC and Gaussian: Density-Functional Theory and Noncovalent Interactions
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