Actually that input file isn't the most flexible, here is a different one
that is more flexible and also only generates one conformer.

crystal_ligand_flex.sdf
<http://forums.openbabel.org/file/n4657427/crystal_ligand_flex.sdf>  



--
View this message in context: 
http://forums.openbabel.org/Generating-a-diverse-set-of-conformers-tp4656011p4657427.html
Sent from the General discussion mailing list archive at Nabble.com.

------------------------------------------------------------------------------
"Accelerate Dev Cycles with Automated Cross-Browser Testing - For FREE
Instantly run your Selenium tests across 300+ browser/OS combos.
Get unparalleled scalability from the best Selenium testing platform available
Simple to use. Nothing to install. Get started now for free."
http://p.sf.net/sfu/SauceLabs
_______________________________________________
OpenBabel-discuss mailing list
OpenBabel-discuss@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/openbabel-discuss

Reply via email to