Thanks Egon, I made a few other experiments with the same compound and it looked Okay. I need to investigate the matter a bit deeper myself. I'll write the results. Adel.
Egon Willighagen wrote: > 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 > > ------------------------------------------------------------------------------ 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
