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AMBER Free Energy Tools: A New Framework for the Design of Optimized Alchemical Transformation Pathways.

Authors :
Tsai, Hsu-Chun
Lee, Tai-Sung
Ganguly, Abir
Giese, Timothy J.
Ebert, Maximilian CCJC
Labute, Paul
Merz Jr., Kenneth M.
York, Darrin M.
Source :
Journal of Chemical Theory & Computation; 1/24/2023, Vol. 19 Issue 2, p640-658, 19p
Publication Year :
2023

Details

Language :
English
ISSN :
15499618
Volume :
19
Issue :
2
Database :
Supplemental Index
Journal :
Journal of Chemical Theory & Computation
Publication Type :
Academic Journal
Accession number :
161513544
Full Text :
https://doi.org/10.1021/acs.jctc.2c00725