Thanks Riccardo.
While I can see Rdkit 2017.09.2.0 is available on conda (
https://anaconda.org/search?q=rdkit), rdkit-postgres seems to be stuck
at 2016.03.4
Can I update the rdkit installation and use it to update the Postgres
extension? Or must I wait for a rdkit-postgres conda with the right
At some point, in the not too distant future (I hope), there will be an
updated version of the cartridge.
On Fri, Dec 8, 2017 at 3:55 PM, Rajarshi Guha
wrote:
> Thanks Riccardo.
>
> While I can see Rdkit 2017.09.2.0 is available on conda (
> https://anaconda.org/search?q=rdkit), rdkit-postgres s
Thanks Greg.
Right now I have
rdkit 2017.09.2.0 py27h080088d_1rdkit
rdkit-postgresql 2016.03.3py27_1rdkit
But when I try to install the extension I get an error
chembl23=# create extension if not exists rdkit;
ERROR: could not load li
Thanks Greg.
I hit some strange problems with similarity search not working after an
upgrade (SSS seemed OK). I never really got to the bottom of this as I
managed to solve it by deleting the RDKit artifacts from the database
and dropping and reinstalling the cartridge and after that all works
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