New force field parameters for metalloproteins I: Divalent copper ion centers including three histidine residues and an oxygen-ligated amino acid residue.
Olivia WiseOrkid CoskunerPublished in: J. Comput. Chem. (2014)
Keyphrases
- amino acids
- force field
- protein sequences
- secondary structure
- amino acid sequences
- protein structure prediction
- protein function
- protein structure
- protein folding
- maximum likelihood
- parameter estimation
- active contours
- active contour model
- information theory
- physicochemical properties
- computational biology
- sequence alignment
- deformable models
- shape parameters
- medical images
- protein families
- experimentally determined
- amino acid residues