MNDO-PM3 study on model cytochrome P450-
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Toshiyuki Katagi
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Article
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1993
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John Wiley and Sons
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English
β 718 KB
## Abstract The reaction mechanism of the model cytochrome P450βmediated desulfuration of thiophosphoryl trifluoride, trimethylphosphine sulfide, and trimethyl phosphorothionate was examined by the semiempirical MNDOβPM3 molecular orbital method. The proposed pathways, involving initial formation o