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Numerical Simulation in Molecular Dynamics
It illustrates modeling, discretization, algorithms and their parallel implementation with MPI on computer systems with distributed memory. The text offers step-by-step explanations of numerical simulation, providing illustrative code examples.
With the description of the algorithms and the presentation of the results of various simulations from fields such as material science, nanotechnology, biochemistry and astrophysics, the reader of this book will learn how to write programs capable of running successful experiments for molecular dynamics.
Publisher: Springer (November 29, 2010)
Language: English
ISBN-10: 3642087760
ISBN-13: 978-3642087769
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