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Volumn 49, Issue 7, 2009, Pages 1692-1703

Predicting activation enthalpies of cytochrome-p450-mediated hydrogen abstractions. 2. Comparison of semiempirical PM3, SAM1, and AM1 with a density functional theory method

Author keywords

[No Author keywords available]

Indexed keywords

ABSTRACTING; ACTIVATION ENERGY; BIOCHEMISTRY; ENTHALPY; HYDROGEN; IONIZATION OF GASES; PREDICTIVE ANALYTICS; REGRESSION ANALYSIS; SUBSTRATES;

EID: 68149168638     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci8003946     Document Type: Article
Times cited : (14)

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