Effective energy functions for protein structure prediction

Curr Opin Struct Biol. 2000 Apr;10(2):139-45. doi: 10.1016/s0959-440x(00)00063-4.

Abstract

Protein structure prediction, fold recognition, homology modeling and design rely mainly on statistical effective energy functions. Although the theoretical foundation of such functions is not clear, their usefulness has been demonstrated in many applications. Molecular mechanics force fields, particularly when augmented by implicit solvation models, provide physical effective energy functions that are beginning to play a role in this area.

Publication types

  • Research Support, Non-U.S. Gov't
  • Research Support, U.S. Gov't, Non-P.H.S.
  • Review

MeSH terms

  • Animals
  • Entropy
  • Humans
  • Models, Chemical
  • Protein Conformation*
  • Protein Folding
  • Solvents
  • Thermodynamics*
  • Vibration

Substances

  • Solvents