Simple, Efficient, and Reliable Computation of Multiple Free Energy Differences from a Single Simulation: A Reference Hamiltonian Parameter Update Scheme for Enveloping Distribution Sampling (EDS)

Published 2009 View Full Article

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Title
Simple, Efficient, and Reliable Computation of Multiple Free Energy Differences from a Single Simulation: A Reference Hamiltonian Parameter Update Scheme for Enveloping Distribution Sampling (EDS)
Authors
Keywords
-
Journal
Journal of Chemical Theory and Computation
Volume 5, Issue 2, Pages 276-286
Publisher
American Chemical Society (ACS)
Online
2009-01-09
DOI
10.1021/ct800424v

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