𝔖 Bobbio Scriptorium
✦   LIBER   ✦

The cell-neighbor table method in molecular dynamics simulations

✍ Scribed by Juan J. Morales; Søren Toxvaerd


Book ID
107745504
Publisher
Elsevier Science
Year
1992
Tongue
English
Weight
409 KB
Volume
71
Category
Article
ISSN
0010-4655

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📜 SIMILAR VOLUMES


Calculations of a list of neighbors in M
✍ Virginia Yip; Ron Elber 📂 Article 📅 1989 🏛 John Wiley and Sons 🌐 English ⚖ 650 KB

The algorithm is based on a grid search and on partitioning of the atoms into boxes rather than on calculations of distances. The effort associated with the generation of the box list grows only linearly with the number of atoms. The algorithm is particularly advantageous for solvated systems. Test