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A charge equilibration formalism for treating charge transfer effects in MD simulations: Application to water clusters.

Sudipta Kumar SinhaMohit MehtaSandeep Patel
Published in: J. Comput. Chem. (2017)
Keyphrases
  • databases
  • clustering algorithm
  • image sequences
  • application specific
  • information retrieval
  • website
  • data points
  • knowledge representation
  • cluster analysis
  • hierarchical clustering
  • simulation model