Binding free energy predictions in host-guest systems using Autodock4. A retrospective analysis on SAMPL6, SAMPL7 and SAMPL8 challenges.

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Bibliographic Details
Title: Binding free energy predictions in host-guest systems using Autodock4. A retrospective analysis on SAMPL6, SAMPL7 and SAMPL8 challenges.
Authors: Casbarra, Lorenzo1, Procacci, Piero1, procacci@unifi.it
Source: Journal of Computer-Aided Molecular Design; Jun2021, Vol. 35 Issue 6, p721-729, 9p
Database: Applied Science & Technology Source
Description
ISSN:0920654X
DOI:10.1007/s10822-021-00388-4