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. Author manuscript; available in PMC: 2011 Oct 19.
Published in final edited form as: Biochemistry. 2010 Oct 19;49(41):9011–9019. doi: 10.1021/bi101139q

Table 2.

Percentage of accurate raloxifene metabolite predictions (out of 100 conformations) from docking raloxifene into CYP3A4

Template Dehydrogenation 3′ Hydroxylation Inactive
1W0E 10% 5% 85%
1W0E_Modified 24% 4% 72%