"Solvation free energies calculated using the GB/SA model: Sensitivity of ..."

M. Rami Reddy et al. (1998)

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DOI: 10.1002/(SICI)1096-987X(199805)19:7<769::AID-JCC7>3.0.CO;2-O

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type: Journal Article

metadata version: 2020-04-01

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M. Rami Reddy, Mark D. Erion, Atul Agarwal, Vellarkad N. Viswanadhan, D. Quentin McDonald, W. Clark Still:
Solvation free energies calculated using the GB/SA model: Sensitivity of results on charge sets, protocols, and force fields. J. Comput. Chem. 19(7): 769-780 (1998)

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