Conformational free-energy difference of a miniprotein from nonequilibrium simulations

Journal of Physical Chemistry Letters

Volumn 1, Issue 13, 2010, Pages 1922-1926

  Spichty, Martin ^a,c   Cecchini, Marco ^a   Karplus, Martin ^a,b  

^a UNIVERSITÉ DE STRASBOURG   (France)

^b HARVARD UNIVERSITY   (United States)

^c UNIVERSITÉ DE LYON   (France)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONALLY EFFICIENT; CONFORMATIONAL STATE; FLUCTUATION THEOREMS; FREE-ENERGY DIFFERENCE; IMPLICIT TREATMENT; MOLECULAR DYNAMICS SIMULATIONS; NON EQUILIBRIUM; NON-EQUILIBRIUM SIMULATIONS; PROTEIN G; THERMODYNAMIC QUANTITIES;

COMPUTATIONAL METHODS; FREE ENERGY; MOLECULAR BIOLOGY; MOLECULAR DYNAMICS;

COMPUTER SIMULATION;

EID: 77954287012     PISSN: None     EISSN: 19487185     Source Type: Journal    
DOI: 10.1021/jz1005016     Document Type: Article

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