Quantum Mechanical Simulation Methods for Studying Biological Systems: Les Houches Workshop, May 2–7, 1995
Dominique Bicout · Martin Field
Mar 2013 · Centre de Physique des Houches Book 4 · Springer Science & Business Media
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It is now generally agreed that a deeper understanding of biological processes requires a multi-disciplinary approach employing the tools of biology, chemistry, and physics. Such understanding involves study of biomacromolecules and their functions, which includes how they interact, their reactions, and how information is transmitted between them. This volume is devoted to quantum mechanical simulation techniques, which have developed rapidly in recent years. It covers quantum mechanical calculations of large systems, molecular dynamics combining quantum and classical algorithms, quantum dynamical simulations, and electron and proton transfer processes in proteins and in solutions.
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