Login / Signup
Converging ligand-binding free energies obtained with free-energy perturbations at the quantum mechanical level.
Martin A. Olsson
Pär Söderhjelm
Ulf Ryde
Published in:
J. Comput. Chem. (2016)
Keyphrases
</>
free energy
energy function
markov random field
belief propagation
energy minimization
prior knowledge
graphical models