> I don't think the problem is in OpenBabel, but I can't tell. RCSB says > they're all describing the same molecule. OpenBabel says they aren't. > Who should I trust and why? So I asked.
No, that's fine. We're happy that you ask these questions. :-) I'd rather know if there's a bug in our software and try to fix it, than to have someone wonder "what the heck is going on." So yes, please ask away. Thanks, -Geoff ------------------------------------------------------------------------------ DreamFactory - Open Source REST & JSON Services for HTML5 & Native Apps OAuth, Users, Roles, SQL, NoSQL, BLOB Storage and External API Access Free app hosting. Or install the open source package on any LAMP server. Sign up and see examples for AngularJS, jQuery, Sencha Touch and Native! http://pubads.g.doubleclick.net/gampad/clk?id=63469471&iu=/4140/ostg.clktrk _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
