Molecular Simulations Fundamentals and Practice
English | 2020 | ASIN: B088JY1FFG | 335 pages | PDF | 8.29 MB

Provides hands-on knowledge enabling students of and researchers in chemistry, biology, and engineering to perform molecular simula
This book introduces the fundamentals of molecular simulations for a broad, practice-oriented audience and presents a thorough overview of the underlying concepts. It covers classical mechanics for many-molecule systems as well as force-field models in classical molecular dynamics; introduces probability concepts and statistical mechanics; and analyzes numerous simulation methods, techniques, and applications.