"SAMPL5: 3D-RISM partition coefficient calculations with partial molar ..."

Tyler Luchko et al. (2016)

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DOI: 10.1007/S10822-016-9947-7

access: closed

type: Journal Article

metadata version: 2020-04-16

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Tyler Luchko, Nikolay Blinov, Garrett C. Limon, Kevin P. Joyce, Andriy Kovalenko:
SAMPL5: 3D-RISM partition coefficient calculations with partial molar volume corrections and solute conformational sampling. J. Comput. Aided Mol. Des. 30(11): 1115-1127 (2016)

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