Amazing. I guess I thought I knew what I'd be doing this weekend - guess I was mistaken.
Depending on how deep they run the Python, this might make another great library on which to build ruby (and perl) interfaces. 2D and 3D coordinate generation, all the other I/O and structure searching capability _and_ a BSD-style license (at least part of it)? Looks excellent so far. cheers, Rich --- Noel O'Boyle <[EMAIL PROTECTED]> wrote: > I've been sitting on this for a day or two while > finding out more > information, but you should check out the > cheminformatics toolkit > RDKit which, like OpenBabel, has its origins in a > commercial > company... > > I've given it a write up here: > > http://baoilleach.blogspot.com/2007/09/rdkit-not-just-yet-another.html > > Noel > > ------------------------------------------------------------------------- > This SF.net email is sponsored by: Microsoft > Defy all challenges. Microsoft(R) Visual Studio > 2005. > http://clk.atdmt.com/MRT/go/vse0120000070mrt/direct/01/ > _______________________________________________ > Blueobelisk-discuss mailing list > [email protected] > https://lists.sourceforge.net/lists/listinfo/blueobelisk-discuss > ___________________________________ Richard L. Apodaca http://depth-first.com Blog http://metamolecular.com Company ------------------------------------------------------------------------- This SF.net email is sponsored by: Microsoft Defy all challenges. Microsoft(R) Visual Studio 2005. http://clk.atdmt.com/MRT/go/vse0120000070mrt/direct/01/ _______________________________________________ Blueobelisk-discuss mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/blueobelisk-discuss
