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setup.py
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#!/opt/epd/bin/python
# -*- coding: utf8 -*-
from setuptools import setup, find_packages
long_description = '''
This python module is a set of routines designed to ease the way of making SIESTA calculations,
adding them to PBS queue and interpreting the results.
'''
setup(name='SHS',
version='0.4',
description='Siesta help scripts',
long_description=long_description,
author='Andrey Sobolev',
author_email='[email protected]',
url='http://asobolev.ddns.info',
packages=find_packages('.'),
package_data={'shs': ['PBS/*.pbs', 'slurm/*'],
'shs.gui': ['data-export-icon.png', ],
},
scripts=['bin/plotmde',
'bin/plotrdf',
'bin/plotmsd',
'bin/gui.py',
'bin/setup_input.py',
],
install_requires=["numpy>=1.8.1",
"scipy>=0.14.0",
"matplotlib>=1.3.1",
"wxPython>=2.8.10.0"],
license='MIT'
)