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.
| Serija: | Lecture Notes in Computational Science and Engineering |
| Leidėjas: | Springer Berlin Heidelberg |
| Išleidimo metai: | 2005 |
| Knygos puslapių skaičius: | 384 |
| ISBN-10: | 3540255427 |
| ISBN-13: | 9783540255420 |
| Formatas: | Knyga minkštu viršeliu |
| Kalba: | Anglų |
| Žanras: | Computational biology / bioinformatics |
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