Subject: metabolism sites in aromatic rings

From: [email-masked] (Mark Murcko)
Date: Thu, 7 Sep 1995 23:08:29 -0500 (EDT)

I know this is a widely-studied field, and I am currently
in the midst of collecting references, but I thought it
would also be wise to tap the Collective Wisdom of the group
on the following topic: 

What molecular orbital methods have been DEMONSTRATED to do 
the best job of explaining/predicting/rationalizing the 
positions on aromatic rings which undergo different types 
of metabolic events?  For example, P450 or xanthine oxidase 
oxidation, etc.  Any help appreciated.

/ Mark ([email-masked])