Hi Marawan,
We don't currently support CSRML. It is certainly an interesting and
flexible format, so it would be cool to have, but it would be a fair amount
of work to implement.
-greg
On Tue, Dec 19, 2023 at 4:19 AM Marawan Hussien via Rdkit-discuss <
rdkit-discuss@lists.sourceforge.net>
Hello,
I am wondering if standard rdkit supports CSRML, I would like to encode the
toxprint chemotypes as binary fingerprints for a bunch of molecules to train
on,
Thanks,Marawan___
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