CCL: Computer Program for Enumeration of Kekule Structures.



 Sent to CCL by: Andreas Klamt [klamt],[cosmologic.de]
 Dear Rashid,
 
indeed our COSMOfrag program does this task as a by product during the preparation of the fragmentation into fragmets from similar structures. But COSMOfrag is not for free. If you just need it for one or a small number of compounds, I can do it for you.
 Best regards
 Andreas
 Zahid Rashid Z.Rashid,,students.uu.nl schrieb:
 
 Sent to CCL by: "Zahid  Rashid" [Z.Rashid[]students.uu.nl]
 Dear C.C. Researchers,
 
I am looking for a computer program that can automatically generate all possible Kekule structures for a given polycyclic (alternant) aromatic hydrocarbon. If anybody have or know about such a program please let me know. Thanks.
 Z.Rashid(-)students.uu.nl>
 
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 Dr. habil. Andreas Klamt
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 e-mail: klamt[*]cosmologic.de
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