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Understanding Molecular Simulation

From Algorithms to Applications

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Pages
679 pages
Reading time
24 hours

More about the book

Focusing on molecular simulation, this book provides insights from chemical-physics and statistical mechanics, emphasizing the development of algorithms and their applications. It caters to both developers and users, guiding them in selecting suitable computational techniques. The text includes pseudocode implementations and case studies to illustrate practical applications. The updated edition reflects significant advancements in simulation techniques and introduces new examples to enhance understanding, making it accessible for readers without prior knowledge of computer simulation.

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Understanding Molecular Simulation, Daan Frenkel, Berend Smit

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Released
2023
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