Aromaticity

From Open Babel
Revision as of 11:55, 4 March 2006 by Joerg Kurt Wegner (Talk | contribs) (Use article link-out)

Jump to: navigation, search

The aromaticity prediction uses a recursive algorithm which takes also electron contributions into account and is much more robust than the non-recursive Meng and Lewis atom typing (Article:ml91) or primitive non-hetero atom assignments (Book:tri92).