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Dissociation of hydrogen peroxide in water and methanol through a biased molecular dynamics investigation.

Hieu C. DongThi H. HoThu M. NguyenYoshiyuki KawazoeHung M. Le
Published in: J. Comput. Chem. (2021)
Keyphrases
  • molecular dynamics
  • high performance computing
  • scientific data
  • molecular dynamics simulations
  • fluid flow
  • protein folding
  • information systems
  • database systems
  • fine grained
  • fault tolerant