I'd say that we should just ignore empty "data_global". Regards, Jean
Le mardi 30 août 2011 à 18:06 +0200, Vincent Favre-Nicolin a écrit : > Le 30/08/2011 17:44, Noel O'Boyle a écrit : > > Google says that data_global is not part of the official standard but > > it is often used in any case. The thread at > > http://www.mail-archive.com/jmol-users@lists.sourceforge.net/msg07178.html > > tells us what Jmol decided to do: "Bob proposed not to ignore > > data_global blocks, as I suggested, > > but to check if they contained structural data, which is a better > > idea.". If you google some more, you might find some more advice. > > Yes, data_global is used so in IUCr journals, so we can go that way > and just issue a warning when finding a "data_global" entry without > crystallographic info. > That should work, at least until some other database/journal/software > decides that data_global is a nice name to put all the crystallographic > data ! > > Jean, what do you think ? It could also be reasonable to ignore any > data_XXX which has no crystallographic information (no UC, no atoms) ? > > Vincent > > ------------------------------------------------------------------------------ > Special Offer -- Download ArcSight Logger for FREE! > Finally, a world-class log management solution at an even better > price-free! And you'll get a free "Love Thy Logs" t-shirt when you > download Logger. Secure your free ArcSight Logger TODAY! > http://p.sf.net/sfu/arcsisghtdev2dev > _______________________________________________ > OpenBabel-Devel mailing list > OpenBabel-Devel@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/openbabel-devel ------------------------------------------------------------------------------ Special Offer -- Download ArcSight Logger for FREE! Finally, a world-class log management solution at an even better price-free! And you'll get a free "Love Thy Logs" t-shirt when you download Logger. Secure your free ArcSight Logger TODAY! http://p.sf.net/sfu/arcsisghtdev2dev _______________________________________________ OpenBabel-Devel mailing list OpenBabel-Devel@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-devel
