Energy landscapes and global thermodynamics for alanine peptides

Journal of Chemical Physics

Volumn 139, Issue 12, 2013, Pages

  Somani, Sandeep ^a   Wales, David J ^a  

^a UNIVERSITY OF CAMBRIDGE   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

AMINO ACIDS; BENCHMARKING; BIOMOLECULES; ELECTRONIC DENSITY OF STATES; MOLECULAR DYNAMICS; PEPTIDES; POTENTIAL ENERGY; QUANTUM CHEMISTRY; THERMODYNAMICS;

ALANINE PEPTIDE; AMBER FORCE-FIELD; ANHARMONICITIES; BIOMOLECULAR SYSTEM; DENSITIES OF STATE; ENERGY LANDSCAPE; ENHANCED SAMPLINGS; PARTITION FUNCTIONS;

MONTE CARLO METHODS;

ALANINE; PEPTIDE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; MOLECULAR DYNAMICS; MONTE CARLO METHOD; THERMODYNAMICS;

ALANINE; MOLECULAR DYNAMICS SIMULATION; MOLECULAR STRUCTURE; MONTE CARLO METHOD; PEPTIDES; THERMODYNAMICS;

EID: 84885462196     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4813627     Document Type: Article

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