## Abstract A detailed description of vector/parallel algorithms for the molecular dynamics (MD) simulation of macromolecular systems on multiple processor, shared‐memory computers is presented. The algorithms encompass three computationally intensive portions of typical MD programs: (__1__) the ev
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The new program OPAL for molecular dynamics simulations and energy refinements of biological macromolecules
✍ Scribed by P. Luginbühl; P. Güntert; M. Billeter; K. Wüthrich
- Publisher
- Springer Netherlands
- Year
- 1996
- Tongue
- English
- Weight
- 875 KB
- Volume
- 8
- Category
- Article
- ISSN
- 0925-2738
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