Update setup.py with 3.2.0 information.

This commit is contained in:
Nathan Baker
2020-06-17 12:33:52 -07:00
parent 616540ebd6
commit 1d8fa2bbbe

View File

@@ -1,19 +1,16 @@
#! /usr/bin/python
# PROPKA 3.1
#
#
# setuptools installation of PROPKA 3.1
# PROPKA 3
from setuptools import setup, find_packages
VERSION = "3.1.1"
VERSION = "3.2.0"
setup(name="PROPKA",
setup(
name="PROPKA",
version=VERSION,
description="Heuristic pKa calculations with ligands",
long_description="""
description="Heuristic pKa calculations with ligands", long_description="""
PROPKA predicts the pKa values of ionizable groups in proteins (version 3.0) and
protein-ligand complexes (version 3.1) based on the 3D structure.
protein-ligand complexes (version 3.1 and later) based on the 3D structure.
For proteins without ligands both version should produce the same result.
@@ -42,21 +39,15 @@ See http://propka.org/ for the PROPKA web server.
'Environment :: Console',
'Intended Audience :: Science/Research',
'License :: OSI Approved :: GNU Lesser General Public License v2 (LGPLv2)',
'Operating System :: POSIX',
'Programming Language :: Python',
'Operating System :: POSIX', 'Programming Language :: Python',
'Topic :: Scientific/Engineering :: Bio-Informatics',
'Topic :: Scientific/Engineering :: Chemistry',
],
packages=find_packages(exclude=['scripts']),
package_data = {'propka': ['*.dat', '*.cfg']},
#scripts = ["scripts/propka31.py"], # use entry point below
entry_points = {
'console_scripts': [
'propka31 = propka.run:main',
],
},
package_data={'propka': ['*.dat', '*.cfg']},
entry_points={'console_scripts': ['propka31 = propka.run:main', ]},
zip_safe=True,
python_requires='>=3.5',
tests_require=["pandas", "numpy"],
test_suite="tests",
)
)