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@@ -3,7 +3,7 @@ | |
setup( | ||
name='pensa', | ||
version='0.3.0', | ||
description='PENSA - Protein ENSemble Analysis', | ||
description='exploratory analysis and comparison of biomolecular conformational ensembles.', | ||
url='http://github.com/drorlab/pensa', | ||
author='Martin Voegele, Neil Thomson, Sang Truong, Jasper McAvity', | ||
author_email='[email protected]', | ||
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@@ -21,7 +21,7 @@ | |
), | ||
zip_safe=False, | ||
install_requires=[ | ||
'numpy==1.22', # because density functions in MDAnalysis 2 use np.histogramdd() with keyword normed which is deprecated in numpy 1.21 and removed in numpy 1.24 | ||
'numpy==1.22', # density functions in MDAnalysis 2 use np.histogramdd() with keyword normed which is deprecated in numpy 1.21 and removed in numpy 1.24 | ||
'scipy>=1.2', | ||
'pandas', | ||
'matplotlib', | ||
|