Predicting Activation Enthalpies of Cytochrome-P450-Mediated Hydrogen Abstractions. 2. Comparison of Semiempirical PM3, SAM1, and AM1 with a Density Functional Theory Method
2009 ◽
Vol 49
(7)
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pp. 1692-1703
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2015 ◽
Vol 127
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pp. 748-752
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Vol 3
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pp. 137-150
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2018 ◽
Vol 14
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pp. 4499-4512
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Vol 750-752
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pp. 044103
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2019 ◽
Vol 1277
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pp. 012026