Rapid Calculation of Accurate Atomic Charges for Proteins via the Electronegativity Equalization Method
Ionescu, Crina-Maria, Geidl, Stanislav, Svobodová Vařeková, Radka, Koča, JaroslavVolume:
53
Language:
english
Journal:
Journal of Chemical Information and Modeling
DOI:
10.1021/ci400448n
Date:
October, 2013
File:
PDF, 579 KB
english, 2013