株式会社極東書店トップ ＞ 商品一覧 ＞ Introduction to Molecular Dynamics Simulations: A Practical Guide Using C/C++, FORTRAN, and Python.
商品詳細
Introduction to Molecular Dynamics Simulations: A Practical Guide Using C/C++, FORTRAN, and Python.
・ISBN 978-1-138-62669-0 hard GB£ 82.00
￥25,977.- (税込) ※（※）価格はご注文時の参考価格となります。
納品価格につきましては書籍の入荷時点で確定となります。
版元の原価改定、外国為替の変動等により異なる場合がございますので、予めご了承下さい。
| 著者・編者 | Beu, Titus A., |
|---|---|
| シリーズ | (Series in Computational Physics) |
| 出版社 | (CRC Press, UK) |
| 出版年月 | 2028 |
| ページ数 | 512 pp. |
| 言語 | ENG |
| ニュース番号 | ＜A00-18997＞ |
解説
This book provides an in-depth introduction to molecular dynamics (MD) simulation, the basis for computational study of complex atomic and molecular systems. The author clarifies the role of different variables and sequences throughout, avoids excessive mathematical detail, emphasizes graphical representations, and highlights illustrative applications in materials science, biology, and biochemistry. The text also presents tips for speeding up calculations and parallelization techniques based on OpenMP. The final section offers hands-on training to open-source MD codes (NAMD) and associated post-processing.