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2009, ISBN 9780521898638, Volume 9780521898638, x, 567
Ab initio molecular dynamics revolutionized the field of realistic computer simulation of complex molecular systems and processes, including chemical reactions, by unifying molecular dynamics... 
Molecular dynamics - Computer simulation | Molecular dynamics
Book
2007, ISBN 9780521835275, Volume 9780521835275, xxvii, 596
The simulation of physical systems requires a simplified, hierarchical approach which models each level from the atomistic to the macroscopic scale... 
Physics | Simulation methods | Physics - Simulation methods
Book
06/2017, ISBN 9780198803195, 641
This book provides a practical guide to molecular dynamics and Monte Carlo simulation techniques used in the modelling of simple and complex liquids... 
Mathematical and Statistical Physics | Physics | Liquids | Mathematical models | Molecular-simulation | Computer-modelling | Monte-Carlo | Molecular-dynamics | Statistical-mechanics | Mesoscale-modelling
eBook
Journal Article
Journal of computational chemistry, ISSN 1096-987X, 2009, Volume 30, Issue 10, pp. 1545 - 1614
Journal Article