[OpenBabel-Devel] Hardening Open Babel (i.e. fuzzing)

2020-04-03 Thread Geoffrey Hutchison
I'm taking some of my work-from-home time to firm up some bug fixes. As part of that, I'm also working to get automated 'fuzz' testing going for Open Babel. If you haven't heard about fuzz testing, it involves feeding various data into programs and libraries to get them to crash. This may take

Re: [OpenBabel-Devel] Fixing distance geometry stereo issue

2020-04-03 Thread Tim Vandermeersch
Hi Geoff, On Wed, Apr 1, 2020 at 5:59 PM Geoffrey Hutchison wrote: > 3) Handling of unpsecified stereochemistry in SMILES-SDF roundtrip test > > Using the SDF file format for the rountrip tests is also problematic. > Although we correctly write out unspecified atom stereo parities, these are > i