hi, I have validated the CDK XlogP descriptor against the program XlogP and MOE , looks fine, article for next CDKNews is written. Uli wanted to validate the TPSA descriptor, I dont know if he could do something. Otherwise I will also do this, I will need this descriptor and I can compare it to the Pipeline Pilot one (still no Java running in PipelinePilot because one needs therefore a server version which I will get next year (2 weeks)).
best regards Christian > --- Ursprüngliche Nachricht --- > Von: Rajarshi Guha <[EMAIL PROTECTED]> > An: [EMAIL PROTECTED] > Kopie: [EMAIL PROTECTED], [email protected] > Betreff: Re: [Cdk-user] CDK subprojects > Datum: Thu, 15 Dec 2005 09:53:34 -0500 > > On Thu, 2005-12-15 at 11:57 +0100, Egon Willighagen wrote: > > > > * QA projects: > > > > . Validating QSAR descriptors (QA-050501-0001)- Matteo, Christian, Egon > > It appears I've been a bit sloppy in handling the QA stuff (since I had > said I would oversee it) :( > > What are you validating against? > > > > * Application projects: > > > > . JChemPaint - Stefan > > . CDK Bioclipse plugin - Egon > > . CDK-Taverna - Egon, Juergen, Thomas > > . Exploring Polymer support - Nina > > . PDB support - Martin, Ola, Egon > > . Jmol integration - Egon > > . CDK-Octet bridge - Rich > > . NMR prediction - Stefan > > Descriptor application - Rajarshi > > ------------------------------------------------------------------- > Rajarshi Guha <[EMAIL PROTECTED]> <http://jijo.cjb.net> > GPG Fingerprint: 0CCA 8EE2 2EEB 25E2 AB04 06F7 1BB9 E634 9B87 56EE > ------------------------------------------------------------------- > The Heineken Uncertainty Principle: > You can never be sure how many beers you had last night. > > > > > ------------------------------------------------------- > This SF.net email is sponsored by: Splunk Inc. Do you grep through log > files > for problems? Stop! Download the new AJAX search engine that makes > searching your log files as easy as surfing the web. DOWNLOAD SPLUNK! > http://ads.osdn.com/?ad_id=7637&alloc_id=16865&op=click > _______________________________________________ > Cdk-user mailing list > [email protected] > https://lists.sourceforge.net/lists/listinfo/cdk-user > -- Lust, ein paar Euro nebenbei zu verdienen? Ohne Kosten, ohne Risiko! Satte Provisionen für GMX Partner: http://www.gmx.net/de/go/partner ------------------------------------------------------- This SF.net email is sponsored by: Splunk Inc. Do you grep through log files for problems? Stop! Download the new AJAX search engine that makes searching your log files as easy as surfing the web. DOWNLOAD SPLUNK! http://ads.osdn.com/?ad_id=7637&alloc_id=16865&op=click _______________________________________________ Cdk-user mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/cdk-user
