Dear all,

TL;DR: Now that RDKit builds are available on conda-forge, I would like to
stop doing builds on the rdkit conda channel. I'm looking for feedback
about that here.

Thanks to the persistence of Peter St John and Matt Swain, the RDKit is now
available on conda-forge:
https://anaconda.org/conda-forge/rdkit/files
If you take a look, you'll find builds for Mac, Linux, and Windows together
with multiple versions of Python. The build/deployment steps are all
automated. It's really cool!

Given that these packages now exist, I don't see much value in continuing
to also host standard RDKit builds in the rdkit conda channel. So I would
propose that we switch to using conda-forge as the primary channel for
doing RDKit builds/distributions. Having the automated process available
would save me a lot of time and remove the chance for me to make a mistake
while doing the builds.[1]
If we go this way, I will update the documentation to point to conda-forge
and will only do the occasional nightly or beta build in the rdkit conda
channel.

Does anyone have any objections to this or see any problems that it might
cause?

Many thanks to Matt and Peter for making the conda-forge builds happen!

-greg
[1] As fun as these are, I think I can live without them. ;-)
_______________________________________________
Rdkit-devel mailing list
Rdkit-devel@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/rdkit-devel

Reply via email to