Advances in the treatment of explicit water molecules in docking and binding free energy calculations

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Authors: Xiao Hu, Irene Maffucci, Alessandro Contini

Journal title: Current Medicinal Chemistry

Journal number: 25

Journal publisher: Bentham Science Publishers

Published year: 2018

DOI identifier: 10.2174/0929867325666180514110824

ISSN: 0929-8673