Conversion of Ab-initio Force Fields and Structures to Molecular Mechanics Energy Functions.
Kim PalmöLars-Olof PietiläSamuel KrimmPublished in: Comput. Chem. (1991)
Keyphrases
- energy function
- graph cuts
- energy minimization
- markov random field
- molecular structure
- protein structure prediction
- molecular dynamics
- active contours
- problems in computer vision
- image segmentation
- global minimum
- belief propagation
- energy functional
- approximate solutions
- segmentation method
- regularization framework
- three dimensional
- shape prior
- protein structure
- smoothness constraint
- submodular functions
- ordering constraints
- computer vision