OPAL: Difference between revisions
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== References == | == References == | ||
* Luginbühl, P., Güntert, P., Billeter, M. & Wüthrich K. The new program OPAL for molecular dynamics simulations and energy refinements of biological macromolecules[http:// | * Luginbühl, P., Güntert, P., Billeter, M. & Wüthrich K. The new program OPAL for molecular dynamics simulations and energy refinements of biological macromolecules[http://uni-frankfurt.guentert.science/Reprints/Luginbuhl96-OPAL.pdf .] [http://dx.doi.org/10.1007/BF00211160 J. Biomol. NMR 8, 136–146 (1996)] | ||
Latest revision as of 17:07, 17 December 2025
Energy refinement and molecular dynamics simulation algorithm for vector supercomputers
OPAL was a program for molecular dynamics (MD) simulation and energy refinement of biological macromolecules optimized for vector supercomputers such as the NEC SX series.
Availability
- OPAL is no longer available or supported. Its functionality has been incoporated into the program OPALp.
References
- Luginbühl, P., Güntert, P., Billeter, M. & Wüthrich K. The new program OPAL for molecular dynamics simulations and energy refinements of biological macromolecules. J. Biomol. NMR 8, 136–146 (1996)