Hi all, On Fri, Oct 1, 2010 at 9:04 AM, Pascal Muller <[email protected]> wrote: >> If I remember correctly the Murcko framework code in the CDK is broken.
I would be *very* useful if the people interested in this functionality could set up (e.g. in the wiki) a set if molecules with the expected murcko hits for those molecules... 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
