From NWChem
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Gets Around
Threads 18
Posts 63
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| 10:42:55 AM PDT - Wed, Sep 30th 2015 |
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Quote:Edoapra Sep 30th 10:26 pmPlesase set the env. variable USE_PYTHONCONFIG=Y
Once this variable is set, all the linking bits should be picked up.
At what stage does the NWChem python interface require libz? Most of my development occurs on a ubuntu 14.04 box and I have not seen this failure.
If you really need any extra library, you can add it to BLASOPT (as a temporary fix)
Thanks for advice Edo, tomorrow I will try to test it.
But I want to add that before compiling NWCHEM I have installed the following packages on Ubuntu 14.04 (from scratch):
sudo apt-get install build-essential
sudo apt-get install python-dev zlib1g-dev libssl-dev gfortran
sudo apt-get install libopenblas-dev
sudo apt-get install libopenmpi-dev openmpi-bin
sudo apt-get install csh
sudo ln -s /usr/lib/python2.7/config-x86_64-linux-gnu /usr/lib/python2.7/config
Vladimir
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Edited On 10:45:41 AM PDT - Wed, Sep 30th 2015 by Vladimir
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