A QM/MM exploration of the potential energy surface of pyruvate to lactate transformation catalyzed by ldh. Improving the accuracy of semiempirical descriptions

Journal of Chemical Theory and Computation

Volumn 1, Issue 4, 2005, Pages 750-761

  Ferrer, Silvia ^c   Ruiz Pernía, J Javier ^c   Tunón, Inaki ^c   Moliner, Vicente ^b   Garcia Viloca, Mireia ^a   González Lafont, Angels ^a   Lluch, José M ^a  

^a UNIVERSITAT AUTÒNOMA DE BARCELONA   (Spain)

^b UNIVERSITAT JAUME I   (Spain)

^c UNIVERSITY OF VALENCIA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 29644433206     PISSN: 15499618     EISSN: 15499626     Source Type: Journal    
DOI: 10.1021/ct050016l     Document Type: Article

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