Do you mean a validation test set? I don't think there is any standard set. You could take a look at the test suites of the various BO projects (OpenBabel, CDK, RDKit, even JOELib) and put one together.
A standard set would be very useful. If you do create one, could you email this list with the details? - Noel On 20 April 2010 13:15, H.-Christian Ehrlich <[email protected]>wrote: > Hello everybody, > > my name is Christian and I am new to the list. I am currently working on a > SMARTS-based substructure search tool and I am looking for a more or less > standard benchmark set. > > I am thankful for any kind of input. > Christian > > --- > H.-Christian Ehrlich > Zentrum für Bioinformatik, Universität Hamburg > Bundesstr. 43 > 22761 Hamburg, Germany > www.zbh.uni-hamburg.de <http://www.zbh.uni-hamburg.de/alllinks.html> > > > > > > > ------------------------------------------------------------------------------ > Download Intel® Parallel Studio Eval > Try the new software tools for yourself. Speed compiling, find bugs > proactively, and fine-tune applications for parallel performance. > See why Intel Parallel Studio got high marks during beta. > http://p.sf.net/sfu/intel-sw-dev > _______________________________________________ > Blueobelisk-discuss mailing list > [email protected] > https://lists.sourceforge.net/lists/listinfo/blueobelisk-discuss > >
------------------------------------------------------------------------------
_______________________________________________ Blueobelisk-discuss mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/blueobelisk-discuss
