Open Source tool for Maximum Common Substructures
Vinod Scaria
Sorry for cross-posting.
Anyone in this list knows of an open source software for searching
Maximum Common Substructures (MCS) for a set of compounds.
We have a set of molecules, and would like to see what are the most
frequent substuctures in the set of molecules.
Any help would be highly appreciated.
Best regards
Vinod
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Dr Vinod Scaria
Scientist
G N Ramachandran Knowledge Centre for Genome Informatics,
CSIR Institute of Genomics and Integrative Biology (CSIR-IGIB),
Mall Road, Delhi 110 007, India
E-mail: vin...@igib.res.in
Web: http://vinodscaria.rnabiology.org/
Mob: +91 9650466002
Lab Address: IGIB Extension Center at Naraina,
A93-94 Naraina Inds Area, Phase 1,Naraina, New Delhi -110 028, Ph-
+91-11-25895615, 45073677/88/99 | Fax no: +91-11-2766 7471
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yatindra yadav
I think this link will work please check it.
http://www.ebi.ac.uk/thornton-srv/software/SMSD/
thanks & regards
Yatindra Nath Yadav
Cheminoformatics Group Leader
OSDD.
http://www.ebi.ac.uk/thornton-srv/software/SMSD/
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