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Showing posts with label
python support
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Showing posts with label
python support
.
Show all posts
05 May 2012
139. compiling nwchem with custom ATLAS on debian
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I'm not yet sure, but there seems to be something weird with this build. Use the openblas build here preferentially: http://verahill.b...
22 April 2012
123. Adding python support to nwchem under debian
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I've posted the general build instructions for nwchem 6.0 with mpi support here: http://verahill.blogspot.com.au/2012/03/nwchem-60-with...
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