We don't support generation of R and S labels. However, we do store the stereochemistry. It's all stored in that config object. Clockwise and Anticlockwise are with respect to the stereo refs in the config. It should be clear enough from the docs (googling "openbabel stereochemistry"): http://openbabel.org/api/2.3.0/group__stereo.shtml
If you are still confused let us know... - Noel On 3 December 2013 18:19, Yoel <yoe...@gmail.com> wrote: > Is it right that you don't support R and S? I'm new to openbabel like two > days old only but I have already seen that > "facade.GetTetrahedralStereo(atom.GetId())" will return OBTetrahedralConfig > (java) wich contain a Config structure/object with a winding property that > has two possible values: clockwise and anticlockwise. These are R ans S to > me! > > I came across this post because I have spent the last four hours trying to > print this out and I can't. I'm using the java binding not the C++ directly > and I don't know how to use the stdout or an alternative. > > > > -- > View this message in context: > http://forums.openbabel.org/stereo-config-question-tp4656879p4656985.html > Sent from the General discussion mailing list archive at Nabble.com. > > ------------------------------------------------------------------------------ > Rapidly troubleshoot problems before they affect your business. Most IT > organizations don't have a clear picture of how application performance > affects their revenue. With AppDynamics, you get 100% visibility into your > Java,.NET, & PHP application. Start your 15-day FREE TRIAL of AppDynamics Pro! > http://pubads.g.doubleclick.net/gampad/clk?id=84349351&iu=/4140/ostg.clktrk > _______________________________________________ > OpenBabel-discuss mailing list > OpenBabel-discuss@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/openbabel-discuss ------------------------------------------------------------------------------ Rapidly troubleshoot problems before they affect your business. Most IT organizations don't have a clear picture of how application performance affects their revenue. With AppDynamics, you get 100% visibility into your Java,.NET, & PHP application. Start your 15-day FREE TRIAL of AppDynamics Pro! http://pubads.g.doubleclick.net/gampad/clk?id=84349351&iu=/4140/ostg.clktrk _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
