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FESetup: Automating Setup for Alchemical Free Energy Simulations. (2015)

First Author: Loeffler HH

Attributed to: Adaptive Multi-Resolution Massively-Multicore Hybrid Dynamics funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jcim.5b00368

PubMed Identifier: 26544598

Publication URI: http://europepmc.org/abstract/MED/26544598

Type: Journal Article/Review

Volume: 55

Parent Publication: Journal of chemical information and modeling

Issue: 12

ISSN: 1549-9596