Path integral simulations of proton transfer reactions in aqueous solution using combined QM/MM potentials

Journal of Chemical Theory and Computation

Volumn 2, Issue 2, 2006, Pages 236-245

  Major, Dan Thomas ^a   Garcia Viloca, Mireia ^a,b   Gao, Jiali ^a  

^a UNIVERSITY OF MINNESOTA   (United States)

^b UNIVERSITAT AUTÒNOMA DE BARCELONA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 33746911013     PISSN: 15499618     EISSN: None     Source Type: Journal    
DOI: 10.1021/ct050257t     Document Type: Article

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