On Wed, Oct 5, 2011 at 11:55 AM, Christoph Steinbeck <[email protected]> wrote: > just wanted to point you attention to a nice piece of work by Karen Schomburg > in the Rarey group in Hamburg. > She developed a way to visualise SMARTS. > Unfortunately, it is not free as in speech, but it *is* free as in beer. > > http://www.smartsview.de
I think it actually makes in interesting student project... with the new JChemPaint design, this is most certainly doable in a few months for at least the more common SMARTS 'atom types'... Egon -- Dr E.L. Willighagen Postdoctoral Researcher Institutet för miljömedicin Karolinska Institutet (http://ki.se/imm) 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 ------------------------------------------------------------------------------ All the data continuously generated in your IT infrastructure contains a definitive record of customers, application performance, security threats, fraudulent activity and more. Splunk takes this data and makes sense of it. Business sense. IT sense. Common sense. http://p.sf.net/sfu/splunk-d2dcopy1 _______________________________________________ Blueobelisk-discuss mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/blueobelisk-discuss
