Interfacial folding and membrane insertion of designed peptides studied by molecular dynamics simulations

Proceedings of the National Academy of Sciences of the United States of America

Volumn 102, Issue 19, 2005, Pages 6771-6776

  Im, Wonpil ^a   Brooks III, Charles L ^a  

^a SCRIPPS RESEARCH INSTITUTE   (United States)

Author keywords

Implicit solvation; Replica exchange molecular dynamics; TMX 1; TMX 3; WALP

Indexed keywords

HELIX LOOP HELIX PROTEIN; PEPTIDE DERIVATIVE;

ARTICLE; CONFORMATIONAL TRANSITION; MEMBRANE; MOLECULAR DYNAMICS; MOLECULAR MODEL; PRIORITY JOURNAL; PROTEIN CONFORMATION; PROTEIN FOLDING; PROTEIN MOTIF; PROTEIN SECONDARY STRUCTURE; SIMULATION; SOLVATION;

AMINO ACID MOTIFS; AMINO ACID SEQUENCE; CELL MEMBRANE; COMPUTER SIMULATION; HYDROGEN BONDING; MEMBRANES; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR CONFORMATION; MOLECULAR SEQUENCE DATA; MUTATION; PEPTIDES; PROLINE; PROTEIN CONFORMATION; PROTEIN DENATURATION; PROTEIN FOLDING; PROTEIN STRUCTURE, SECONDARY; PROTEIN STRUCTURE, TERTIARY; SOFTWARE; TEMPERATURE; THERMODYNAMICS; TIME FACTORS;

EID: 18744403982     PISSN: 00278424     EISSN: None     Source Type: Journal    
DOI: 10.1073/pnas.0408135102     Document Type: Article

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