Large variation in electrostatic contours upon addition of steric parameters and the effect of charge calculation schemes in CoMFA on mutagenicity of MX analogues

Author: Gadhe Changdev G.   Kothandan Gugan   Cho Seung Joo  

Publisher: Taylor & Francis Ltd

ISSN: 0892-7022

Source: Molecular Simulation, Vol.38, Iss.11, 2012-09, pp. : 861-871

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