CCL: AW: Retrosynthesis
- From: Markus Sitzmann <sitzmann{:}helix.nih.gov>
- Subject: CCL: AW: Retrosynthesis
- Date: Wed, 25 Jul 2012 17:52:24 -0400
Sent to CCL by: Markus Sitzmann [sitzmann ~~ helix.nih.gov]
Well, I can tell you for sure that the person who last maintained
the link sent by Ernst left years ago ( me :-) ), but you still
might ask Molecular Networks (http://www.molecular-networks.com)
for a copy of WODCA.
Best,
Markus
On 7/25/2012 4:25 PM, Horkel, Ernst ehorkel**ioc.tuwien.ac.at wrote:
Sent to CCL by: "Horkel, Ernst" [ehorkel(!)ioc.tuwien.ac.at]
Hi,
have a look at
http://www2.chemie.uni-erlangen.de/software/wodca/
However, I do not know if it is further maintained...
Best Regards,
Ernst
______________________________________________________
Univ.Ass. Dipl.-Ing. Dr.techn. Ernst Horkel
Institute of Applied Synthetic Chemistry,
Vienna University of Technology Tel.: +43-1-58801-163609
Getreidemarkt 9/163OC, +43-664-60588-7122
A-1060 Vienna, Austria Fax: +43-1-58801-15499
email: ehorkel]-[ioc.tuwien.ac.at
-----Ursprüngliche Nachricht-----
Von: owner-chemistry+ehorkel==ioc.tuwien.ac.at]-[ccl.net [mailto:owner-chemistry+ehorkel==ioc.tuwien.ac.at]-[ccl.net]
Im Auftrag von Steve Watkins lloyd.riggs===gmx.ch
Gesendet: Dienstag, 24. Juli 2012 12:08
An: Horkel, Ernst
Betreff: CCL: Retrosynthesis
Sent to CCL by: "Steve Watkins" [lloyd.riggs .. gmx.ch]
Dear Users,
I am looking for retrosynthesis software (GPL or Free). I found only an
outdated version of OSET/CAOS. Others are no longer free. As such, I am
looking for pointers or suggestions.
In addition, I am also trying to find a free reaction database such as the ACD
type, which list molecules, reactions etc...which can be used with
retrosynthesis software.
Any suggestions or help are appriciated
Sincerely,
Stephan Watkinshttp://www.ccl.net/cgi-bin/ccl/send_ccl_messagehttp-:-//www.ccl.net/chemistry/sub_unsub.shtmlhttp-:-//www.ccl.net/spammers.txt>
--
Markus Sitzmann, Ph.D.
Chemical Biology Laboratory
Center for Cancer Research
National Cancer Institute
National Institutes of Health
376 Boyles St
Frederick, MD 21702, USA
301-846-5974 (office)
301-846-6033 (fax)
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