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setup.py
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setup.py
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from setuptools import setup
setup(
name='gallop',
version='0.1.3',
description='Fast crystal structure determination from powder diffraction data',
url='https://github.com/mspillman/gallop',
author='Mark Spillman',
author_email='markspillman@gmail.com',
license='GPLv3',
packages=['gallop', 'gallop.optim', 'gallop.files'],
package_data={'gallop': ['gallop/example_data/*.*',
'gallop/user_settings/Default.json',
'gallop/atomic_scattering_params.json']},
include_package_data=True,
scripts=['gallop_streamlit.py', 'gallop.bat'],
install_requires=['pymatgen==2023.12.18',
'numpy',
'torch',
'scipy>=1.7.0',
'matplotlib',
'torch-optimizer',
'altair<5',
'streamlit==1.11.1',
'pandas',
'py3Dmol',
'mpld3',
],
)