Hey Tim, I hope all is well with you.
Someone was just asking me whether this is possible to enumerate tautomers with OB (for ligand preparation for docking), and I've just discovered your tautomerism code from last November. The code seems to implement Roger Sayle's recipe up until the keto/enol part. Are you planning to add in support for keto/enol in the future? - Noel ------------------------------------------------------------------------------ Virtualization & Cloud Management Using Capacity Planning Cloud computing makes use of virtualization - but cloud computing also focuses on allowing computing to be delivered as a service. http://www.accelacomm.com/jaw/sfnl/114/51521223/ _______________________________________________ OpenBabel-Devel mailing list OpenBabel-Devel@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-devel
