CCL: free descriptors software program
- From: "Ivanciuc, Ovidiu I."
<oiivanci===utmb.edu>
- Subject: CCL: free descriptors software program
- Date: Fri, 3 Aug 2007 12:04:50 -0500
Sent to CCL by: "Ivanciuc, Ovidiu I." [oiivanci\a/utmb.edu]
> Do you know any free programs that calculate molecular descriptors?
Parameter Client
http://www.vcclab.org/
http://www.vcclab.org/lab/pclient/
http://146.107.217.178/lab/pclient/
E-Dragon
http://www.vcclab.org/lab/edragon/
http://146.107.217.178/lab/edragon/
MODEL - Molecular Descriptor Lab
http://jing.cz3.nus.edu.sg/cgi-bin/model/model.cgi
PreADMET
http://preadmet.bmdrc.org/preadmet/index.php
http://preadmet.bmdrc.org/preadmet/query/query1.php
And if you need efficient machine learning soft for these
descriptors, take a look at:
http://www.support-vector-machines.org/SVM_soft.html
Regards,
Ovidiu Ivanciuc
Sealy Center for Structural Biology and Molecular Biophysics
Department of Biochemistry and Molecular Biology
University of Texas Medical Branch
301 University Boulevard
Galveston, Texas 77555-0857
USA
http://ivanciuc.org
Email: oiivanci{=}utmb.edu
Email: iejmd{=}yahoo.com
IEJMD: http://www.biochempress.com
CoEPrA: http://coepra.org