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An automated analysis workflow for optimization of force-field parameters using neutron scattering data.

Vickie E. LynchJose M. BorregueroDebsindhu BhowmikPanchapakesan GaneshBobby G. SumpterThomas ProffenMonojoy Goswami
Published in: J. Comput. Phys. (2017)
Keyphrases
  • data analysis
  • automated analysis
  • data mining
  • prior knowledge
  • global optimization
  • big data
  • image processing
  • pairwise
  • knowledge discovery
  • input data
  • region of interest
  • surface reconstruction