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Introduction to Molecular Mechanics by C. David Sherrill(PDF 43p)

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Introduction to Molecular Mechanics by C. David Sherrill(PDF 43p)

Introduction to Molecular Mechanics by C. David Sherrill(PDF 43p)

This note covers the following topics: Stretching Interactions, The Force-Field, Stretch Energy, Bend Energy, Torsional Energy, van der Waals Energy, Electrostatic Energy, Fitting Atomic Charges, The Fluctuating Charge Model, Other Polarizable Models, Parameterizing the Force Fields and Heats of Formation.

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s43 Pages

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