AMOEBA binding free energies for the SAMPL7 TrimerTrip host-guest challenge

Yuanjun Shi, Marie L. Laury, Zhi Wang, Jay W. Ponder. AMOEBA binding free energies for the SAMPL7 TrimerTrip host-guest challenge. Journal of Computer-Aided Molecular Design, 35(1):79-93, 2021. [doi]

Abstract

Abstract is missing.