Molecular dynamics prediction of the mechanism of ester hydrolysis in water

Journal of the American Chemical Society

Volumn 130, Issue 46, 2008, Pages 15232-15233

  Gunaydin, Hakan ^a   Houk, K N ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ESTER; WATER;

ARTICLE; CATALYSIS; HYDROGEN BOND; HYDROLYSIS; IONIZATION; MOLECULAR DYNAMICS; PREDICTION;

COMPUTER SIMULATION; ESTERS; HYDROLYSIS; MODELS, MOLECULAR; MOLECULAR STRUCTURE; WATER;

EID: 56449124791     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja8050525     Document Type: Article

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