From owner-chemistry@ccl.net Fri Aug 3 15:32:00 2007 From: "Ivanciuc, Ovidiu I. oiivanci===utmb.edu" To: CCL Subject: CCL: free descriptors software program Message-Id: <-34871-070803135826-4116-0bBT1S5j/0UI39OvtaVgXQ{=}server.ccl.net> X-Original-From: "Ivanciuc, Ovidiu I." Content-class: urn:content-classes:message Content-Transfer-Encoding: 8bit Content-Type: text/plain; charset="iso-8859-1" Date: Fri, 3 Aug 2007 12:04:50 -0500 MIME-Version: 1.0 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