CSAC 391 - Computational Chemistry

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Topics include models for the rotation and vibration of diatomic and polyatomic molecules and their visualization, molecular mechanics using semi-empirical force fields, and molecular dynamics of polypeptides, polynucleotides, and their interactions with drugs. (Same course offered as CHEM 391.) Prerequisite(s): CHEM 172,PHYS 221,CSAC 245 or CS 245;