Absolute free energy and entropy of a mobile loop of the enzyme acetylcholinesterase

Journal of Physical Chemistry B

Volumn 113, Issue 22, 2009, Pages 7950-7964

  Mihailescu, Mihail ^a   Meirovitch, Hagai ^a  

^a UNIVERSITY OF PITTSBURGH SCHOOL OF MEDICINE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; DYNAMICS; FREE ENERGY; MOLECULAR DYNAMICS;

ACETYLCHOLINESTERASE; BULK WATER; EXPERIMENTAL DATA; EXPERIMENTAL VALUES; EXPLICIT WATER; MD SIMULATION; RAY COORDINATES; REVERSIBLE DISSOCIATION; SIDE CHAINS; TEMPLATE SIZES; TOTAL FREE ENERGY; WATER DENSITY; WATER MOLECULE; X-RAY STRUCTURE;

MOLECULES;

EID: 66549092123     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp900308y     Document Type: Article

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