Molecular Dynamics Simulation: Elementary Methods

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Author: Author

Pages: 512

Size: 1.802,08 Kb

Publication Date: March 14,1997

Category: Physical Chemistry



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“Provides a large amount of reading pleasure and several new insights.” -Journal of Molecular Framework

“This is actually the most amusing, stimulating and useful publication which can be completely recommended to a person with a pastime in computer simulation.” -Modern Physics

“An extremely useful launch .

Stresses easy-to-make use of molecules
* Provides sample calculations and statistics
* Contains four full FORTRAN codes .” -Journal of the American Chemical Culture

Written specifically for the novice, Molecular Dynamics Simulation demonstrates how molecular dynamics simulations function and how exactly to perform them, concentrating on how exactly to devise a model for particular molecules and how exactly to simulate their motions using a computer. even more interesting to read compared to the often dried out equation-based texts. This reserve provides a assortment of methods that as yet have already been scattered through the literature of the last 25 years. It reviews components of sampling theory and discusses how contemporary notions of chaos and non-linear dynamics describe the workings of molecular dynamics. .


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