On 7 October 2010 21:15, Geoffrey Hutchison <ge...@geoffhutchison.net> wrote: >> I've spent a little while on this, but it's all new to me and a bit >> tricky. About half of the failings are caused by -N3, the azide > > OK, first batch done. I'll take a look at the rest tonight or tomorrow.
I'm not seeing any improvement. I'll have another go later. The IMPVAL value is the number of bonds the matching atom can make (where a double bond counts as 2 bonds)...right? > -Geoff > > ------------------------------------------------------------------------------ Beautiful is writing same markup. Internet Explorer 9 supports standards for HTML5, CSS3, SVG 1.1, ECMAScript5, and DOM L2 & L3. Spend less time writing and rewriting code and more time creating great experiences on the web. Be a part of the beta today. http://p.sf.net/sfu/beautyoftheweb _______________________________________________ OpenBabel-Devel mailing list OpenBabel-Devel@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-devel
