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Molecular dynamics - Blue matter: approaching the limits of concurrency for classical molecular dynamics.

Blake G. FitchAleksandr RayshubskiyMaria EleftheriouT. J. Christopher WardMark GiampapaMichael PitmanRobert S. Germain
Published in: SC (2006)
Keyphrases
  • molecular dynamics
  • high performance computing
  • scientific data
  • protein folding
  • molecular dynamics simulations
  • database systems
  • data collection
  • fluid flow
  • databases
  • data processing
  • building blocks