My comment was referring to the OB library, and your implementation is not in there. As contributed code it may be useful to people, but having it in the library would expand the capabilities of 'obabel' and friends.
- Noel On 4 December 2012 17:55, Igor Filippov [Contr] <igor.filip...@nih.gov> wrote: > It's great, Noel, but... no MCS in OpenBabel? :( > I completely agree that my implementation is not perfect but it does > work within some reasonable limits... > > Igor > > On 12/4/2012 12:48 PM, Craig James wrote: >> Very nice ... thanks for doing this. Things like this should be >> available in the OB documentation as a resource for those starting new >> projects or trying to make a presentation to their management. >> >> Craig >> >> On Tue, Dec 4, 2012 at 3:31 AM, Noel O'Boyle <baoille...@gmail.com >> <mailto:baoille...@gmail.com>> wrote: >> >> Hi all, >> >> Here are some introductory slides to features and usage of Open Babel: >> http://baoilleach.blogspot.co.uk/2012/12/intro-to-open-babel.html >> >> Regards, >> Noel >> >> >> ------------------------------------------------------------------------------ >> LogMeIn Rescue: Anywhere, Anytime Remote support for IT. Free Trial >> Remotely access PCs and mobile devices and provide instant support >> Improve your efficiency, and focus on delivering more value-add services >> Discover what IT Professionals Know. Rescue delivers >> http://p.sf.net/sfu/logmein_12329d2d >> _______________________________________________ >> OpenBabel-discuss mailing list >> OpenBabel-discuss@lists.sourceforge.net >> <mailto:OpenBabel-discuss@lists.sourceforge.net> >> https://lists.sourceforge.net/lists/listinfo/openbabel-discuss >> >> >> >> >> ------------------------------------------------------------------------------ >> LogMeIn Rescue: Anywhere, Anytime Remote support for IT. Free Trial >> Remotely access PCs and mobile devices and provide instant support >> Improve your efficiency, and focus on delivering more value-add services >> Discover what IT Professionals Know. Rescue delivers >> http://p.sf.net/sfu/logmein_12329d2d >> >> >> >> _______________________________________________ >> OpenBabel-discuss mailing list >> OpenBabel-discuss@lists.sourceforge.net >> https://lists.sourceforge.net/lists/listinfo/openbabel-discuss >> > > ------------------------------------------------------------------------------ > LogMeIn Rescue: Anywhere, Anytime Remote support for IT. Free Trial > Remotely access PCs and mobile devices and provide instant support > Improve your efficiency, and focus on delivering more value-add services > Discover what IT Professionals Know. Rescue delivers > http://p.sf.net/sfu/logmein_12329d2d > _______________________________________________ > OpenBabel-discuss mailing list > OpenBabel-discuss@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/openbabel-discuss ------------------------------------------------------------------------------ LogMeIn Rescue: Anywhere, Anytime Remote support for IT. Free Trial Remotely access PCs and mobile devices and provide instant support Improve your efficiency, and focus on delivering more value-add services Discover what IT Professionals Know. Rescue delivers http://p.sf.net/sfu/logmein_12329d2d _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
