Open AccessDiscrete Molecular Dynamics Distinguishes Nativelike Binding Poses from Decoys in Difficult Targets
Author(s) -
Elizabeth A. Proctor,
Shuangye Yin,
Alexander Tropsha,
Nikolay V. Dokholyan
Publication year - 2012
Publication title -
carolina digital repository (university of north carolina at chapel hill)
Language(s) - English
DOI - 10.17615/v9jg-9039
Subject(s) - dynamics (music) , computational biology , molecular dynamics , computer science , chemistry , biology , physics , computational chemistry , acoustics