Designing safer chemicals: predicting the rates of metabolism of halogenated alkanes.

A computational model is presented that can be used as a tool in the design of safer chemicals. This model predicts the rate of hydrogen-atom abstraction by cytochrome P450 enzymes. Excellent correlations between biotransformation rates and the calculated activation energies (delta Hact) of the cyto...

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Sonraí Bibleagrafaíochta
Main Authors: Yin, H, Anders, M W, Korzekwa, K R, Higgins, L, Thummel, K E, Kharasch, E D, Jones, J P
Formáid: Artigo
Teanga:Inglês
Foilsithe: 1995
Ábhair:
Research Article
Rochtain Ar Líne:https://ncbi.nlm.nih.gov/pmc/articles/PMC40574/
https://ncbi.nlm.nih.gov/pubmed/7479940
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