AMOEBA binding free energies for the SAMPL7 TrimerTrip host–guest challenge.

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Bibliographic Details
Title: AMOEBA binding free energies for the SAMPL7 TrimerTrip host–guest challenge.
Authors: Shi, Yuanjun1, Laury, Marie L.1, Wang, Zhi1, Ponder, Jay W.1,2, ponder@dasher.wustl.edu
Source: Journal of Computer-Aided Molecular Design; 2021, Vol. 35 Issue 1, p79-93, 15p
Database: Applied Science & Technology Source
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Description
ISSN:0920654X
DOI:10.1007/s10822-020-00358-2