ENGLISH

New Algorithms for Macromolecular Simulation

By Benedict Leimkuhler , Peter J. Bond , Jonathan Cuthbertson , Sundeep S. Deol , Lucy R. Forrest (auth.) , Christophe Chipot , Ron Elber , Aatto Laaksonen , Alan Mark , Tamar Schlick , Christoph Schütte , Robert Skeel (eds.)

Book information

Publisher
Springer-Verlag Berlin Heidelberg
Year
2006
ISBN
9783540255420, 3540255427
DOI
10.1007/3-540-31618-3
Open Library ID
OL9055502M
Language
english
Format
PDF
Filesize
8 MB (7880703 bytes)
Series
Lecture Notes in Computational Science and Engineering 49
Edition
1
Pages
367\384
Library
kolxoz
Time added
2010-02-18 13:16:04
Simulation and Modeling; Mathematical Biology in G

Description

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.

Similar books