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setup.py
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33 lines (32 loc) · 1.06 KB
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# setup.py
from setuptools import setup, find_packages
'''
setup file
'''
setup(
name='FormatTransformer', # package name
version='0.1', # version
description='Convert XYZ trajectories to VASP POSCAR files and center structures',
long_description=open('README.md').read(),
author='Rahul Verma',
author_email='rverma7@ncsu.edu',
packages=find_packages(include=["src"]),
install_requires=['numpy', 'ase', 'MDAnalysis', 'tqdm'],
classifiers = [
'Programming Language :: Python :: 3',
'License :: OSI Approved :: MIT License',
'Operating System :: OS Independent',
'Intended Audience :: Science/Research',
'Topic :: Scientific/Engineering',
],
python_requires = '>=3.0',
keywords = 'FormatTransformer',
url = '',
docs_url = '',
entry_points={ # Command-line scripts
'console_scripts': [
'xyzcenter = src.center_molecule:main',
'xyzconverter = src.writer:main',
],
},
)