Files required for PIP.

MANIFEST.in

@@ -0,0 +1,2 @@
+include README.md
+

setup.cfg

@@ -0,0 +1,2 @@
+[metadata]                                                                                    
+description-file = README.md

setup.py

@@ -24,31 +24,29 @@
 #   31062 Toulouse Cedex 4      
 #   scemama@irsamc.ups-tlse.fr 
 
+import sys                                                                                    
 
+import setuptools
 
-from distutils.core import setup
+with open("README.md", "r") as fh:
+    long_description = fh.read()
 
-"""
+setuptools.setup(
-- To create a source distribution, run:
+  name="resultsFile",
-
+  version='1.0',
-python setup.py sdist
+  author="Anthony Scemama",
-
+  author_email="scemama@irsamc.ups-tlse.fr",
-- To install the module, run:
+  description="Module for reading output files of quantum chemistry codes.",
-
+  long_description=long_description,
-python setup.py install
+  long_description_content_type="text/markdown",
-
+  url="https://gitlab.com/scemama/resultsFile",
-- To create an rpm distribution
+  download_url="https://gitlab.com/scemama/resultsFile/-/archive/v1.0/resultsFile-v1.0.tar.gz",
-
+  packages=setuptools.find_packages(),
-python setup.py bdist_rpm
+  classifiers=[
-"""
+         "Programming Language :: Python :: 2",
-
+         "License :: OSI Approved :: GNU General Public License v2 or later (GPLv2+)",
-import os
+         "Operating System :: POSIX :: Linux",
-setup(name="resultsFile",
+     ],
-      version=os.getenv("VERSION","1.0"),
+  keywords = ['quantum chemistry', 'GAMESS', 'Gaussian', 'Molpro'],
-      author="Anthony Scemama",
+ )                                                        
-      author_email="scemama@irsamc.ups-tlse.fr",
-      license="gpl-license",
-      description="Module for I/O on Quantum Chemistry files.",
-      packages=["resultsFile","resultsFile.lib","resultsFile.Modules"]
-      )