rdkit/rdkit — pull request #312 by ptosco (2014-08-18 15:14:47+00:00)
Title: Herschbach-Laurie fallback implemented to fix GitHub 308

- fixed a bug which caused the MMFF parameterization code
to segfault when a system not listed in the MMFFBndk
table was found. The Herschbach-Laurie fallback according
to MMFF.V was implemented and a relevant test was added
in testMMFFHelpers.cpp