Update executable script name.

Changed script name to propka3 based on https://github.com/jensengroup/propka-3.1/pull/61#discussion_r442326049

Updated additional information in setup.py
This commit is contained in:
Nathan Baker
2020-06-18 08:57:12 -07:00
parent 573b38db38
commit 7a25ec6598
3 changed files with 12 additions and 10 deletions

View File

@@ -6,7 +6,7 @@ from setuptools import setup, find_packages
VERSION = "3.2.0"
setup(
name="PROPKA",
name="propka",
version=VERSION,
description="Heuristic pKa calculations with ligands", long_description="""
PROPKA predicts the pKa values of ionizable groups in proteins (version 3.0) and
@@ -31,6 +31,8 @@ See http://propka.org/ for the PROPKA web server.
""",
author="Jan H. Jensen",
author_email="jhjensen@chem.ku.dk",
maintainer="Nathan Baker",
maintainer_email="nathanandrewbaker@gmail.com",
license="LGPL v2.1",
url="http://propka.org",
keywords="science",
@@ -45,9 +47,9 @@ See http://propka.org/ for the PROPKA web server.
],
packages=find_packages(exclude=['scripts']),
package_data={'propka': ['*.dat', '*.cfg', '*.json']},
entry_points={'console_scripts': ['propka32 = propka.run:main', ]},
entry_points={'console_scripts': ['propka3 = propka.run:main', ]},
zip_safe=True,
python_requires='>=3.5',
tests_require=["pandas", "numpy"],
tests_require=["pandas", "numpy", "pytest"],
test_suite="tests",
)