Structure and dynamics of an unfolded protein examined by molecular dynamics simulation

Journal of the American Chemical Society

Volumn 134, Issue 8, 2012, Pages 3787-3791

  Lindorff Larsen, Kresten ^a   Trbovic, Nikola ^a,b   Maragakis, Paul ^a   Piana, Stefano ^a   Shaw, David E ^a,b  

^a D E SHAW RESEARCH   (United States)

^b Howard Hughes Medical Institute   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ACID-UNFOLDED STATE; DIRECT CALCULATION; DISORDERED PROTEINS; DISORDERED STATE; DYNAMICAL FEATURES; EXPERIMENTAL DATA; FOLDED PROTEINS; FORCE FIELDS; GLOBAL STRUCTURE; HELICAL STRUCTURES; MD SIMULATION; MOLECULAR DYNAMICS SIMULATIONS; NMR RELAXATION; ORDERS OF MAGNITUDE; STRUCTURAL BIOLOGY; STRUCTURAL FEATURE; STRUCTURE AND DYNAMICS; TIME-SCALES; UNFOLDED PROTEINS;

DYNAMICS; MOLECULAR DYNAMICS; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PROTEIN FOLDING;

PROTEINS;

DIAZEPAM BINDING INHIBITOR;

ACCURACY; AMINO TERMINAL SEQUENCE; ARTICLE; HYDROPHOBICITY; MOLECULAR DYNAMICS; NUCLEAR MAGNETIC RESONANCE; PROTEIN ANALYSIS; PROTEIN CONFORMATION; PROTEIN FUNCTION; PROTEIN STRUCTURE; PROTEIN UNFOLDING; SIMULATION; SPECTROMETRY; STRUCTURE ACTIVITY RELATION; STRUCTURE ANALYSIS;

DIAZEPAM BINDING INHIBITOR; MOLECULAR DYNAMICS SIMULATION; MOLECULAR STRUCTURE; PROTEIN UNFOLDING; THERMODYNAMICS;

EID: 84857774493     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja209931w     Document Type: Article

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