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Efficient solvation free energy simulations: impact of soft-core potential and a new adaptive λ-spacing method
Mecklenfeld, Andreas, Raabe, GabrieleLanguage:
english
Journal:
Molecular Physics
DOI:
10.1080/00268976.2017.1292008
Date:
March, 2017
File:
PDF, 1.07 MB
english, 2017