Hi,
the aromaticity typer bug is fixed.
see joelib.data.JOEAromaticTyper
We use a prescreening of all available root atoms. Then, when picking
new root atoms for bridging root atoms we check if the new root atom is
a ring without root atom !!!
Regards, Joerg
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Dipl. Chem. Joerg K. Wegner
Center of Bioinformatics Tuebingen (ZBIT)
Department of Computer Architecture
Univ. Tuebingen, Sand 1, D-72076 Tuebingen, Germany
Phone: (+49/0) 7071 29 78970
Fax: (+49/0) 7071 29 5091
E-Mail: mailto:we...@in...
WWW: http://www-ra.informatik.uni-tuebingen.de
--
Never mistake motion for action.
E. Hemingway
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