Uncertainty Quantification in Alchemical Free Energy Methods

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Authors: Agastya P. Bhati, Shunzhou Wan, Yuan Hu, Brad Sherborne, Peter V. Coveney

Journal title: Journal of Chemical Theory and Computation

Journal number: 14/6

Journal publisher: American Chemical Society

Published year: 2018

Published pages: 2867-2880

DOI identifier: 10.1021/acs.jctc.7b01143

ISSN: 1549-9618