Login / Signup

Artificial reaction coordinate "tunneling" in free-energy calculations: The catalytic reaction of RNase H.

Edina RostaH. Lee Woodcock IIIBernard R. BrooksGerhard Hummer
Published in: J. Comput. Chem. (2009)
Keyphrases
  • free energy
  • belief propagation
  • upper bound
  • higher order
  • high quality
  • objective function
  • unsupervised learning
  • fixed point