Hi,
just a heads-up that I'm seeing the following error on MacOS on trying to
create the rdkit extension in a chembl_28 db.
chembl_28=# create extension if not exists rdkit;
ERROR: could not load library
"/Users/drew/anaconda3/envs/rdkit-psql-2021/lib/rdkit.so":
dlopen(/Users/drew/anaconda3/envs
Hi Greg,
I can confirm the issue is solved here.
Cheers !
Drew
On Sun, 28 Mar 2021 at 08:32, Greg Landrum wrote:
> Hi Drew,
>
> Thanks for pointing out the problem. I had inadvertently done the conda
> builds using freetype, but I forgot to add a freetype dependency.
> It should be fixed now.
Hello,
I have installed anaconda3 on Ubuntu 16.04.3 LTS, and have installed
the rdkit-postgresql95
conda environment.
When trying to install the cartridge on a new db, I get the message -
ERROR: could not open extension control file "/home/drew/anaconda3/envs/
rdkit/share/postgresql/extension/
Hello, and compliments of the season to you, RDKitters :)
I'm having trouble getting the conda build of the DB package (
rdkit-postgresql95) working.
The issue I'm having occurs when trying to initialise the rdkit DB
extension on a newly created DB, eg...
createdb emolecules
psql -c 'create exte
Hi,
I am just installing the conda build on Windows, and it looks like I am
getting rdkit 2017.09.1 rather than 2018.03.2
Current conda install:
platform : win-64
conda version : 4.3.23
conda is private : False
conda-env version : 4.3.23
conda-build version : not installed
u sure that you are installing 64bit version? This
> https://anaconda.org/rdkit/rdkit says that the version you have installed
> is present in win-32 build if I am not mistaken.
>
>
>
> Best,
>
> Lukas
>
>
>
> *From: *Drew Gibson via Rdkit-discuss >
> *Repl
Hi,
I'm using the 2019-03.1 conda build of the new version of rdkit-postgresql
on macOS Mohave 10.14.4.
just FYI, I got the following error when trying to create the cartridge
extension in a postgresql chembl_25 instance in the conda build -
chembl_25=# create extension if not exists rdkit;
ERRO
Hi, hope you are enjoying your holidays too :)
There is no specific "RDKit SDF Writer" node in Knime. Not to worry - the
Knime "SDF Writer" node is all you need.
You may need to convert from Knime molecule to RDKit molecule types (and
back again) to get things to work. Also, have you set your o
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