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Erratum to: Lessons learned from comparing molecular dynamics engines on the SAMPL5 dataset.

Michael R. ShirtsChristoph KleinJason M. SwailsJian YinMichael K. GilsonDavid L. MobleyDavid A. CaseEllen D. Zhong
Published in: J. Comput. Aided Mol. Des. (2017)
Keyphrases
  • lessons learned
  • molecular dynamics
  • future directions
  • case study
  • scientific data
  • high performance computing
  • molecular dynamics simulations
  • database
  • protein folding
  • fluid flow
  • information systems