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Computation of free energy differences through nonequilibrium stochastic dynamics: The reaction coordinate case.

Tony LelièvreMathias RoussetGabriel Stoltz
Published in: J. Comput. Phys. (2007)
Keyphrases
  • free energy
  • belief propagation
  • dynamical systems
  • fixed point
  • upper bound
  • least squares
  • three dimensional
  • incremental learning