> open-babel perhaps already supports it. > The format is: > t # methane (name of molecule or any other information you want to put such > as number of atoms/bonds..etc)
Nope, it's not already in OB. Sorry. Seems like it should be easy to code. -Geoff ------------------------------------------------------------------------------ Live Security Virtual Conference Exclusive live event will cover all the ways today's security and threat landscape has changed and how IT managers can respond. Discussions will include endpoint security, mobile security and the latest in malware threats. http://www.accelacomm.com/jaw/sfrnl04242012/114/50122263/ _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
