Free energy for protein folding from nonequilibrium simulations using the Jarzynski equality

Journal of Chemical Physics

Volumn 125, Issue 20, 2006, Pages

  West, Daniel K ^a   Olmsted, Peter D ^b   Paci, Emanuele ^a  

^a UNIVERSITY OF LEEDS   (United Kingdom)

^b NONE

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC PHYSICS; COMPUTATIONAL METHODS; COMPUTER SIMULATION; FREE ENERGY; MOLECULAR STRUCTURE; RELAXATION PROCESSES;

FREE ENERGY DIFFERENCE; JARZYNSKI EQUALITY; NONEQUILIBRIUM SIMULATIONS; RELAXATION TIME;

PROTEINS;

PROTEIN;

ALGORITHM; ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; ENERGY TRANSFER; ENTROPY; MOTION; PROTEIN CONFORMATION; PROTEIN FOLDING; ULTRASTRUCTURE;

ALGORITHMS; COMPUTER SIMULATION; ENERGY TRANSFER; ENTROPY; MODELS, CHEMICAL; MODELS, MOLECULAR; MOTION; PROTEIN CONFORMATION; PROTEIN FOLDING; PROTEINS;

EID: 33751579133     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2393232     Document Type: Article

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