"Predicting hydration free energies using all-atom molecular dynamics ..."

Pavel V. Klimovich, David L. Mobley (2010)

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DOI: 10.1007/S10822-010-9343-7

access: closed

type: Journal Article

metadata version: 2020-05-30

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Pavel V. Klimovich, David L. Mobley:
Predicting hydration free energies using all-atom molecular dynamics simulations and multiple starting conformations. J. Comput. Aided Mol. Des. 24(4): 307-316 (2010)

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