Realistic sampling of amino acid geometries for a multipolar polarizable force field

© 2015 The Authors. Journal of Computational Chemistry Published by Wiley Periodicals, Inc.

Détails bibliographiques
Publié dans:Journal of computational chemistry. - 1984. - 36(2015), 24 vom: 15. Sept., Seite 1844-57
Auteur principal: Hughes, Timothy J (Auteur)
Autres auteurs: Cardamone, Salvatore, Popelier, Paul L A
Format: Article en ligne
Langue:English
Publié: 2015
Accès à la collection:Journal of computational chemistry
Sujets:Journal Article Research Support, Non-U.S. Gov't conformational sampling electrostatics kriging protein data bank quantum chemical topology quantum theory of atoms in molecules Amino Acids