Computational Chemistry 3.8 - Molecular Dynamics
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 Published On Mar 16, 2017

Short lecture on the molecular dynamics algorithm.

Molecular dynamics is one method to approximate the average properties of a chemical system using a Newtonian classical mechanics trajectory through time, using a molecular mechanics energy function. The ergodic hypothesis says that a simulation through sufficiently large time or over sufficiently large space should produce the same results.

Notes Slide: http://i.imgur.com/sVi3tmK.png

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