Open AccessUsing quantum mechanics to improve estimates of amino acid side chain rotamer energies
Author(s) -
Glenn L. Butterfoss,
P. Douglas Renfrew,
Brian Kuhlman
Publication year - 2020
Publication title -
unc libraries
Language(s) - English
DOI - 10.17615/m8s1-nk62
Subject(s) - conformational isomerism , chain (unit) , molecular mechanics , quantum chemical , quantum , statistical physics , computational chemistry , physics , quantum mechanics , classical mechanics , theoretical physics , chemistry , molecular dynamics , molecule
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