Free energy calculation on enzyme reactions with an efficient iterative procedure to determine minimum energy paths on a combined ab initio QM/MM potential energy surface

Journal of Chemical Physics

Volumn 112, Issue 8, 2000, Pages 3483-3492

  Zhang, Yingkai ^a   Liu, Haiyan ^a   Yang, Weitao ^a  

^a DUKE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000145441     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.480503     Document Type: Article

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