Hi all, 1. When converting a sdf file (see attached) for carbon monoxide to smi format I get the following smi result:
[C-]#[OH] 2. Hydrogens are inserted when converting the smiles P#P for the diphosphorus molecule to sdf format (see attached) using gen3d. Best wishes, Scott CO.sdf <http://forums.openbabel.org/file/n4657287/CO.sdf> P2.sdf <http://forums.openbabel.org/file/n4657287/P2.sdf> -- View this message in context: http://forums.openbabel.org/Two-smi-conversion-problems-tp4657287.html Sent from the General discussion mailing list archive at Nabble.com. ------------------------------------------------------------------------------ Learn Graph Databases - Download FREE O'Reilly Book "Graph Databases" is the definitive new guide to graph databases and their applications. Written by three acclaimed leaders in the field, this first edition is now available. Download your free book today! http://p.sf.net/sfu/13534_NeoTech _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
