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Persistent URL http://purl.org/net/epubs/work/24092508
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Record Id 24092508
Title FESetup: Automating Setup for Alchemical Free Energy Simulations
Contributors
Abstract
Organisation STFC , SCI-COMP
Keywords
Funding Information EPSRC; BBSRC; Royal Society
Related Research Object(s): 30454977
Licence Information:
Language English (EN)
Type Details URI(s) Local file(s) Year
Journal Article J Chem Inf Model 55, no. 12 (2015): 2485-2490. doi:10.1021/acs.jcim.5b00368 2015