Energetic and entropic contributions to the interactions between like-charged groups in cationic peptides: A molecular dynamics simulation study

Protein Science

Volumn 11, Issue 8, 2002, Pages 2001-2009

  Villarreal, Marcos ^a   Montich, Guillermo ^b  

^a Centro de Investigaciones En Quimica Biologica de Cordoba   (Argentina)

^b UNIVERSIDAD NACIONAL DE CÓRDOBA   (Argentina)

Author keywords

Ala Lys peptides; Electrostatic interactions; Helical peptides; Like charges interactions; Molecular dynamics simulation; Solvent polarization

Indexed keywords

ACETYLALANYLLYSYLALANYLALANYLALANYLLYSINE AMINOMETHYL ESTER; ALANINE; CATION; HEXAPEPTIDE; LYSINE; SOLVENT; UNCLASSIFIED DRUG;

ALPHA HELIX; ARTICLE; ATOM; CALCULATION; ENERGY TRANSFER; ENTROPY; FORCE; MOLECULAR DYNAMICS; POLARIZATION; PRIORITY JOURNAL; PROTEIN CONFORMATION; SIMULATION; SOLVATION; VAN DER WAALS INTERACTION;

CATIONS; COMPUTER SIMULATION; ELECTROSTATICS; ENERGY TRANSFER; ENTROPY; LYSINE; MODELS, MOLECULAR; PEPTIDES; PROTEIN CONFORMATION; PROTEIN FOLDING; SOLVENTS; SUBSTRATE SPECIFICITY;

EID: 0036078747     PISSN: 09618368     EISSN: None     Source Type: Journal    
DOI: 10.1110/ps.0203002     Document Type: Article

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