Yes,
sorry, I did not mention that. But I did that, too.
Soren
--
Dr. Soren Wacker
Centre For Molecular Simulations, BI # 547
The University of Calgary
2500 University Drive (NW)
Calgary, Alberta
Canada, T2N 1N4
Tel.: ++1 (403) 210 7860
Email: [email protected]
________________________________
From: Greg Landrum [[email protected]]
Sent: Monday, March 16, 2015 10:42 PM
To: Soren Wacker
Cc: RDKit Discuss
Subject: Re: [Rdkit-discuss] Wired dependencies.
Hi Soren,
On Mon, Mar 16, 2015 at 11:58 PM, Soren Wacker
<[email protected]<mailto:[email protected]>> wrote:
Hi,
I am using conda and rdkit, so installed
https://github.com/rdkit/conda-rdkit
with
conda build boost
conda build rdkit
The installation seems to be successfull, at least in part, since I can import
and use rdkit.
Did you also do:
conda install boost
conda install rdkit
in the environment you want to use?
-greg
However, I noticed some strange behaviour:
When I activate a conda environment and import rdkit from ipython notebook, the
kernel will crash.
Apparently, I have to use the system python version at /usr/bin/python and
import the packages installed with conda.
Also upgrading the python packages with conda update --all will lead to a not
working installation.
Any ideas how to solve that? Or where it may come from?
kind regards
Soren
------------------------------------------------------------------------------
Dive into the World of Parallel Programming The Go Parallel Website, sponsored
by Intel and developed in partnership with Slashdot Media, is your hub for all
things parallel software development, from weekly thought leadership blogs to
news, videos, case studies, tutorials and more. Take a look and join the
conversation now. http://goparallel.sourceforge.net/
_______________________________________________
Rdkit-discuss mailing list
[email protected]<mailto:[email protected]>
https://lists.sourceforge.net/lists/listinfo/rdkit-discuss
------------------------------------------------------------------------------
Dive into the World of Parallel Programming The Go Parallel Website, sponsored
by Intel and developed in partnership with Slashdot Media, is your hub for all
things parallel software development, from weekly thought leadership blogs to
news, videos, case studies, tutorials and more. Take a look and join the
conversation now. http://goparallel.sourceforge.net/
_______________________________________________
Rdkit-discuss mailing list
[email protected]
https://lists.sourceforge.net/lists/listinfo/rdkit-discuss
