Simulations of the pressure and temperature unfolding of an α-helical peptide

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

Volumn 102, Issue 19, 2005, Pages 6765-6770

  Paschek, Dietmar ^a,b   Gnanakaran, S ^c   Garcia, Angel E ^b,c,d  

^a TU DORTMUND UNIVERSITY   (Germany)

^b CENTER FOR NONLINEAR STUDIES   (United States)

^c LOS ALAMOS NATIONAL LABORATORY   (United States)

^d Research Rensselaer Polytechnic Institute   (United States)

Author keywords

Folding; IR spectroscopy; Replica exchange molecular dynamics; Thermodynamics

Indexed keywords

CARBONYL DERIVATIVE; PROTEIN; WATER;

ALPHA HELIX; ARTICLE; HYDRATION; INFRARED SPECTROSCOPY; MOLECULAR DYNAMICS; MONTE CARLO METHOD; PRESSURE; PRIORITY JOURNAL; PROTEIN FOLDING; SIMULATION; TEMPERATURE; THERMODYNAMICS;

CARBON; COMPUTER SIMULATION; LYSINE; MONTE CARLO METHOD; OLIGOPEPTIDES; PEPTIDES; PRESSURE; PROTEIN CONFORMATION; PROTEIN DENATURATION; PROTEIN FOLDING; PROTEIN STRUCTURE, SECONDARY; SOFTWARE; SPECTROPHOTOMETRY, INFRARED; TEMPERATURE; THERMODYNAMICS; TIME FACTORS;

MUS;

EID: 18744415073     PISSN: 00278424     EISSN: None     Source Type: Journal    
DOI: 10.1073/pnas.0408527102     Document Type: Article

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