Molecular Dyanmics Simualtion: Elementary Methods by Haile J.M.

By Haile J.M.

Written in particular for the amateur, Molecular Dynamics Simulation demonstrates how molecular dynamics simulations paintings and the way to accomplish them, concentrating on how one can devise a version for particular molecules after which the best way to simulate their hobbies utilizing a working laptop or computer. This e-book presents a set of tools that before were scattered during the literature of the final 25 years. It reports parts of sampling idea and discusses how sleek notions of chaos and nonlinear dynamics clarify the workings of molecular dynamics.

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