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A smooth-particle mesh Ewald method for DL_POLY molecular dynamics simulation package on the Fujitsu VPP700.

Kholmirzo KholmurodovWilliam SmithKenji YasuokaThomas A. DardenToshikazu Ebisuzaki
Published in: J. Comput. Chem. (2000)
Keyphrases
  • mathematical model
  • database
  • databases
  • image sequences
  • finite element method
  • molecular dynamics