On Thu, Sep 30, 2010 at 5:08 PM, Adel Golovin <[email protected]> wrote: > cdk-1.3.4
Good. On the bus home I wrote four new unit tests for the fingerprinter, and using the AtomContainerAtomPermutor and AtomContainerBondPermutor on two molecules, and that showed no problems. If you send me your file I can use that for a test too (which I would upload to the repository, if you are OK with that...) Egon -- Dr E.L. Willighagen Post-doc @ Uppsala University (only until 2010-09-30) Proteochemometrics / Bioclipse Group of Prof. Jarl Wikberg Homepage: http://egonw.github.com/ LinkedIn: http://se.linkedin.com/in/egonw Blog: http://chem-bla-ics.blogspot.com/ PubList: http://www.citeulike.org/user/egonw/tag/papers ------------------------------------------------------------------------------ Start uncovering the many advantages of virtual appliances and start using them to simplify application deployment and accelerate your shift to cloud computing. http://p.sf.net/sfu/novell-sfdev2dev _______________________________________________ Cdk-user mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/cdk-user
