Pairwise energies for polypeptide coarse-grained models derived from atomic force fields

Journal of Chemical Physics

Volumn 130, Issue 19, 2009, Pages

  Betancourt, Marcos R ^a   Omovie, Sheyore J ^a  

^a INDIANA UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AMPHIPHILIC; ATOMIC FORCE FIELD; ATOMIC LEVELS; BOLTZMANN INVERSION; CHARGED RESIDUES; COARSE GRAINED MODELS; COARSE-GRAINED POTENTIAL; EQUILIBRIUM SIMULATIONS; EXPLICIT WATER; FORCE FIELDS; HYDROPHOBICITY SCALE; KNOWLEDGE-BASED METHODS; NATIVE STATE; NATIVE STRUCTURES; PAIRWISE INTERACTION; PARAMETRIZATION; POLARIZATION EFFECT; RADIAL DENSITY; STATISTICAL ENERGY;

AMINATION; AMINES; AMINO ACIDS; ATOMS; DYNAMICS; HYDROPHOBICITY; KNOWLEDGE BASED SYSTEMS; LARGE SCALE SYSTEMS; MODEL STRUCTURES; MOLECULAR DYNAMICS; ORGANIC ACIDS; POLYPEPTIDES;

SIMULATORS;

PEPTIDE; SOLVENT;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; HYDROPHOBICITY; PROTEIN CONFORMATION; THERMODYNAMICS;

HYDROPHOBICITY; MODELS, CHEMICAL; MODELS, MOLECULAR; PEPTIDES; PROTEIN CONFORMATION; SOLVENTS; THERMODYNAMICS;

EID: 65949084921     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3137045     Document Type: Article

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