From: |
"Dr. Heinz Schiffer" <schiffer "-at-" h1tw0036.hoec |
Date: |
Mon, 28 Jul 1997 17:28:59 +0200 |
Subject: |
search for condensed rings |
Dear netters,
I am looking for a simple algorithm to find all rings in a given
molecular structure (given by cartesian coordinates and connectivities).
The molecules have less than 100 atoms. I someone of you already
have such a program, it would be nice to have a copy of it.
Ciao,
Heinz
--
Dr. Heinz Schiffer Phone ++49-69-305-2330
Hoechst CR&T Fax ++49-69-305-81162
Scientific Computing, G864 Email schiffer-0at0-h1tw0036.hoechst.com
65926 Frankfurt am Main Schiffer : at : CRT.hoechst.com
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