Temperature and pressure denaturation of chignol Folding and unfolding simulation by multibaric-multithermal molecular dynamics method

Proteins: Structure, Function and Bioinformatics

Volumn 80, Issue 10, 2012, Pages 2397-2416

  Okumura, Hisashi ^a,b  

^a National Institutes of Natural Sciences   (Japan)

^b GRADUATE UNIVERSITY FOR ADVANCED STUDIES   (Japan)

Author keywords

Folding pathway; Folding thermodynamics; Free energy of unfolding; Hydration water; Potential of mean force; Protein folding; Thermal denaturation

Indexed keywords

CHIGNOLIN; PROTEIN; UNCLASSIFIED DRUG; WATER;

ALPHA HELIX; AMINO TERMINAL SEQUENCE; ANALYTIC METHOD; ARTICLE; BETA SHEET; CARBOXY TERMINAL SEQUENCE; ENERGY; ENTHALPY; ENTROPY; HYDRATION; HYDROPHOBICITY; MOLECULAR DYNAMICS; MOLECULAR MODEL; PRESSURE; PRIORITY JOURNAL; PROTEIN CONFORMATION; PROTEIN DENATURATION; PROTEIN FOLDING; PROTEIN STRUCTURE; PROTEIN UNFOLDING; SIMULATION; TEMPERATURE DEPENDENCE;

ALGORITHMS; MODELS, MOLECULAR; MOLECULAR DYNAMICS SIMULATION; NUCLEAR MAGNETIC RESONANCE, BIOMOLECULAR; OLIGOPEPTIDES; PRESSURE; PROTEIN CONFORMATION; PROTEIN DENATURATION; PROTEIN FOLDING; TEMPERATURE; THERMODYNAMICS;

EID: 84865972845     PISSN: 08873585     EISSN: 10970134     Source Type: Journal    
DOI: 10.1002/prot.24125     Document Type: Article

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