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-Cyclodextrin Conformation Analysis from Replica Exchange Molecular Dynamics.

Wasinee KhuntaweeManaschai KunasethChompoonut RungnimSuradej IntagornPeter WolschannNawee KungwanThanyada RungrotmongkolSupot Hannongbua
Published in: J. Chem. Inf. Model. (2017)
Keyphrases
  • data mining
  • protein folding
  • molecular dynamics
  • fine grained
  • load balancing
  • numerical simulations
  • fault tolerance