File:Understanding Molecular.pdf

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Understanding_Molecular.pdf(file size: 31.42 MB, MIME type: application/pdf)

This is a book introducing atomistic simulation, including MC, MD, etc.

The authors proposed an approach to calculate free energy in MD, namely thermodynamic integration method.

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current23:18, 2 October 2014 (31.42 MB)Terrywen (Talk | contribs)This is a book introducing atomistic simulation, including MC, MD, etc. The authors proposed an approach to calculate free energy in MD, namely thermodynamic integration method.
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