Energetics of infinite homopolypeptide chains: A new look at commonly used force fields

Journal of Physical Chemistry B

Volumn 112, Issue 22, 2008, Pages 6872-6877

  Penev, Evgeni ^a   Ireta, Joel ^b   Shea, Joan Emma ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b DEPARTAMENTO DE QUÍMICA   (Mexico)

Author keywords

[No Author keywords available]

Indexed keywords

DISCRETE FOURIER TRANSFORMS; NETWORK PROTOCOLS; POTENTIAL ENERGY; POTENTIAL ENERGY SURFACES; PROBABILITY DENSITY FUNCTION; QUANTUM CHEMISTRY; SENSOR NETWORKS;

CHARGE FORCE FIELDS; CYLINDRICAL COORDINATES; DESCRIPTORS; ENERGY SURFACES; FORCE FIELDS; GAS-PHASE; HELICAL CONFORMATIONS; LEVEL DENSITY; NON-BONDED INTERACTIONS; NOVEL METHODS; POLARIZABLE FORCE FIELD; POLYALANINE; POLYPEPTIDE CHAINS;

DENSITY FUNCTIONAL THEORY;

PEPTIDE; POLYALANINE;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; COMPUTER SIMULATION; PROTEIN CONFORMATION; QUANTUM THEORY;

COMPUTER SIMULATION; MODELS, CHEMICAL; PEPTIDES; PROTEIN CONFORMATION; QUANTUM THEORY;

EID: 46749098354     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp800058f     Document Type: Article

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