On Mon, May 4, 2009 at 10:24 AM, Chris Pudney <ch...@focal-technologies.com> wrote: > I'm migrating some CDK code from 1.0.1 to 1.2.1 - the code performs two > main functions: > > 1. 2D structure diagram generation > 2. structure diagram rendering
Please use the CDKAtomTypeMatcher to perceive atom types; hydrogen adding and aromaticity detection requires atom types to be recognized in order to decide on the underlying (missing) chemistry. Egon -- Post-doc @ Uppsala University http://chem-bla-ics.blogspot.com/ ------------------------------------------------------------------------------ Register Now & Save for Velocity, the Web Performance & Operations Conference from O'Reilly Media. Velocity features a full day of expert-led, hands-on workshops and two days of sessions from industry leaders in dedicated Performance & Operations tracks. Use code vel09scf and Save an extra 15% before 5/3. http://p.sf.net/sfu/velocityconf _______________________________________________ Cdk-user mailing list Cdk-user@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/cdk-user
