Free energy surface for Brønsted acid-catalyzed glucose ring-opening in aqueous solution

Journal of Physical Chemistry B

Volumn 117, Issue 39, 2013, Pages 11460-11465

  Qian, Xianghong ^a  

^a University of Arkansas   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

FREE ENERGY; GLUCOSE; MOLECULAR DYNAMICS; PROTONS;

ACIDIC AQUEOUS SOLUTION; FREE ENERGY SURFACE; GLUCOPYRANOSE; HIGH AFFINITY; METADYNAMICS SIMULATIONS; RING STRUCTURES; SOLVENT INDUCED; WATER MOLECULE;

SOLUTIONS;

ACID; ALDEHYDE; CARBON; GLUCOSE; HYDROGEN; OXYGEN; SOLVENT; WATER;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; CONFORMATION; MOLECULAR DYNAMICS; SOLUTION AND SOLUBILITY; THERMODYNAMICS;

ACIDS; ALDEHYDES; CARBON; GLUCOSE; HYDROGEN; MODELS, CHEMICAL; MOLECULAR CONFORMATION; MOLECULAR DYNAMICS SIMULATION; OXYGEN; SOLUTIONS; SOLVENTS; THERMODYNAMICS; WATER;

EID: 84885152235     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp402739q     Document Type: Article

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