setup.py

#!/usr/bin/env python
# -*- coding: utf-8 -*-

# Copyright (C) 2019 The ProteinDF development team.
# see also AUTHORS and README if provided.
#
# This file is a part of the ProteinDF software package.
#
# The ProteinDF is free software: you can redistribute it and/or modify
# it under the terms of the GNU General Public License as published by
# the Free Software Foundation, either version 3 of the License, or
# (at your option) any later version.
#
# The ProteinDF is distributed in the hope that it will be useful,
# but WITHOUT ANY WARRANTY; without even the implied warranty of
# MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
# GNU General Public License for more details.
#
# You should have received a copy of the GNU General Public License
# along with ProteinDF.  If not, see <http://www.gnu.org/licenses/>.

import shutil
from setuptools import setup

shutil.copyfile("scripts/pdfcmd.py", "scripts/pdf")
setup()

# import sys
# import os
# from setuptools import setup, find_packages

# exec(open("proteindf_tools/_version.py").read())


# setup(
#     name="proteindf_tools",
#     version=__version__,
#     description="python scripts for ProteinDF package",
#     author="Toshiyuki HIRANO",
#     author_email="hiracchi@gmail.com",
#     url="http://proteindf.github.io/",
#     license="GPLv3",
#     packages=["proteindf_tools"],
#     scripts=[
#         "scripts/pdf",
#         "scripts/pdf-archive.py",
#         "scripts/pdf-archive-h5.py",
#         "scripts/pdf-atom-index.py",
#         "scripts/pdf-env.py",
#         "scripts/pdf-estimate-ao.py",
#         "scripts/pdf-info-geom.py",
#         "scripts/pdf-info-orb.py",
#         "scripts/pdf-info-xyz.py",
#         "scripts/pdf-make-basis2.py",
#         "scripts/pdf-mat-info.py",
#         "scripts/pdf-mat-show.py",
#         "scripts/pdf-plot-basisset.py",
#         "scripts/pdf-plot-elevel.py",
#         "scripts/pdf-plot-mat.py",
#         "scripts/pdf-plot-dos.py",
#         "scripts/pdf-plot-pop.py",
#         "scripts/pdf-plot-decaymat.py",
#         "scripts/pdf-report.py",
#         "scripts/pdf-report-h5.py",
#         "scripts/pdf-reg-harris.py",
#         "scripts/pdf-show-profile.py",
#         "scripts/pdf-test.py",
#         "scripts/pdf-test-h5.py",
#         "scripts/pdf-test-eri.py",
#         "scripts/xyz2gau.py",
#         "scripts/xyz2pdf.py",
#         "scripts/g0xeri2mpac.py",
#         "scripts/pdf-pop-classo.py",
#         "scripts/pdf-pop-ridge.py",
#         "scripts/pdf-pop-resp.py",
#         "scripts/pdf-pop-rrms.py",
#         "scripts/pdf-set-charges.py",
#     ],
#     install_requires=[
#         "h5py",
#         "BeautifulSoup4",
#         "numpy",
#         "scipy",
#         "pandas",
#         "matplotlib",
#         "scikit-learn",
#         # 'proteindf_bridge'
#     ],
#     package_data={"proteindf_tools": ["data/basis2.cache"]},
# )