New Algorithms for Macromolecular Simulation

New Algorithms for Macromolecular Simulation
Author :
Publisher : Springer Science & Business Media
Total Pages : 364
Release :
ISBN-10 : 9783540316183
ISBN-13 : 3540316183
Rating : 4/5 (183 Downloads)

Book Synopsis New Algorithms for Macromolecular Simulation by : Benedict Leimkuhler

Download or read book New Algorithms for Macromolecular Simulation written by Benedict Leimkuhler and published by Springer Science & Business Media. This book was released on 2006-03-22 with total page 364 pages. Available in PDF, EPUB and Kindle. Book excerpt: Molecular simulation is a widely used tool in biology, chemistry, physics and engineering. This book contains a collection of articles by leading researchers who are developing new methods for molecular modelling and simulation. Topics addressed here include: multiscale formulations for biomolecular modelling, such as quantum-classical methods and advanced solvation techniques; protein folding methods and schemes for sampling complex landscapes; membrane simulations; free energy calculation; and techniques for improving ergodicity. The book is meant to be useful for practitioners in the simulation community and for those new to molecular simulation who require a broad introduction to the state of the art.


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