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Atom 6 5 hc - PowerPoint PPT Presentation

Computational Chemistry

Computational Chemistry. Molecular Mechanics/Dynamics F = Ma Quantum Chemistry Schr Ö dinger Equation H  = E . Simulation of a pair of polypeptides. Duration: 100 ps. Time step: 1 ps (Ng, Yokojima & Chen, 2000). Large Gear Drives Small Gear. G. Hong et. al., 1999.

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Atom 6 5 hc - PowerPoint PPT Presentation

Computational Chemistry