All, I'm using the OB C++ API and I wwas wondering whether there is a way to retrieve bot Kekule structure from an aromatic system (if there are two Kekule's)? For example, I would like to get access to both Kekule forms of the aromatic indole ( c1ccc2c(c1)[nH]cc2 ), hence [NH]1C=CC2=CC=CC=C12 and [NH]1C=CC2=C1C=CC=C2
Any C++ API methods available or alternative ideas? Thank you, Hans ------------------------------------------------------------------------------ Increase Visibility of Your 3D Game App & Earn a Chance To Win $500! Tap into the largest installed PC base & get more eyes on your game by optimizing for Intel(R) Graphics Technology. Get started today with the Intel(R) Software Partner Program. Five $500 cash prizes are up for grabs. http://p.sf.net/sfu/intelisp-dev2dev _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
