I think I'd better add this option to Pybel. In the meanwhile, here's how
using the Open Babel library directly:
http://baoilleach.blogspot.com/2008/10/generating-inchis-mini-me-inchikey.html
- Noel
On 26 April 2012 14:16, Maciek Wójcikowski mac...@wojcikowski.pl wrote:
Hello everyone,
Is it possible to set conversion options in pybel? I couldn't find any
information about it.
Pozdrawiam, | Best regards,
Maciek Wójcikowski
mac...@wojcikowski.pl
--
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
--
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