[Debichem-devel] Bug#936536: fmcs: Python2 removal in sid/bullseye
Stuart Prescott
stuart at debian.org
Fri Jan 10 05:21:02 GMT 2020
As noted in #733861, FMCS is now part of python3-rdkit.
With python3-rdkit installed, the following provides fmcs with Python 3 (once
#945985 is sorted out)
$ python3
>>> from rdkit.Chem import fmcs
>>>
I propose that we simply drop the fmcs source package; it has no rdeps other
than the debichem-cheminformatics blends package (which already includes
python3-rdkit). Explicitly adding FMCS to the description of python3-rdkit and
perhaps a Provides python3-fmcs would make it more discoverable.
(It would be possible to expose fmcs so that a simple "import fmcs" worked but
that doesn't seem like the direction that upstream is going, so I don't
propose we do so)
If there are no objections over the coming days, I'll implement this plan.
--
Stuart Prescott http://www.nanonanonano.net/ stuart at nanonanonano.net
Debian Developer http://www.debian.org/ stuart at debian.org
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