Hi Christian, On Wed, Apr 21, 2010 at 12:14 PM, Noel O'Boyle <baoille...@gmail.com> wrote:
> 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. > The CDK has an extensive set of tests in this class: http://github.com/egonw/cdk/blob/master/src/test/org/openscience/cdk/smiles/smarts/parser/SMARTSSearchTest.java Regards, Egon -- Post-doc @ Uppsala University Proteochemometrics / Bioclipse Group of Prof. Jarl Wikberg Homepage: http://egonw.github.com/ Blog: http://chem-bla-ics.blogspot.com/ PubList: http://www.citeulike.org/user/egonw/tag/papers
------------------------------------------------------------------------------
_______________________________________________ Blueobelisk-discuss mailing list Blueobelisk-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/blueobelisk-discuss
