A Gibbs free energy correlation for automated docking of carbohydrates.
Anthony D. HillPeter J. ReillyPublished in: J. Comput. Chem. (2008)
Keyphrases
- free energy
- belief propagation
- markov random field
- upper bound
- competitive learning
- fixed point
- posterior distribution
- approximate inference
- graphical models
- generalized belief propagation
- image processing
- maximum a posteriori
- graph cuts
- self organizing maps
- conditional random fields
- energy function
- energy minimization
- message passing
- markov chain monte carlo