4 Commits

Author	SHA1	Message	Date
Greg Landrum	e145175047	remove getNumExplicitHs; change getTotalNumHs	2012-12-08 07:05:00 +00:00
Greg Landrum	e011d14fb1	add the kappa descriptors	2012-10-28 17:00:29 +00:00
Greg Landrum	b3268d197f	versions for the new connectivity descriptors; replace the python version of chi descriptors with the C++ version	2012-10-27 16:10:17 +00:00
Greg Landrum	fdccec7216	initial pass at c++ implementation of some connectivity descriptors	2012-10-27 15:24:35 +00:00