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Visualizing and identifying conformational ensembles in molecular dynamics trajectories.

Christoph BestHans-Christian Hege
Published in: Comput. Sci. Eng. (2002)
Keyphrases
  • molecular dynamics
  • protein folding
  • high performance computing
  • molecular dynamics simulations
  • scientific data
  • coarse grained
  • high level
  • data generation