Hi all, I have two structures and when I perform OBIsomorphismMapper I get some unexpected results, and I wanted to double check my interpretation.
When i do OBIsomorphismMapper on the two molecules( see images below), i expect the match to be the atoms adjacent of the non-ring bond, instead I'm getting a match in the ring. http://forums.openbabel.org/file/n4404825/molecule.png http://forums.openbabel.org/file/n4404825/fragment.png Is this correct? Thanks, Andi -- View this message in context: http://forums.openbabel.org/Subgraph-isomorphism-tp4404825p4404825.html Sent from the General discussion mailing list archive at Nabble.com. ------------------------------------------------------------------------------ Try before you buy = See our experts in action! The most comprehensive online learning library for Microsoft developers is just $99.99! Visual Studio, SharePoint, SQL - plus HTML5, CSS3, MVC3, Metro Style Apps, more. Free future releases when you subscribe now! http://p.sf.net/sfu/learndevnow-dev2 _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss