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ERICAs: Enabling insights into ab initio Molecular Dynamics simulations.

Kyle Wm. HallEdelsys Codorniu-HernándezPeter G. KusalikSheelagh Carpendale
Published in: PacificVis (2015)
Keyphrases
  • molecular dynamics
  • molecular dynamics simulations
  • high performance computing
  • scientific data
  • protein folding
  • data mining
  • fluid flow
  • databases
  • information systems
  • active learning
  • protein structure prediction