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OpenAtom: Scalable Ab-Initio Molecular Dynamics with Diverse Capabilities.

Nikhil JainEric J. BohmEric MikidaSubhasish MandalMinjung KimPrateek JindalQi LiSohrab Ismail-BeigiGlenn J. MartynaLaxmikant V. Kalé
Published in: ISC (2016)
Keyphrases
  • molecular dynamics
  • high performance computing
  • scientific data
  • protein folding
  • molecular dynamics simulations
  • fluid flow
  • databases
  • information systems
  • database systems