old_contents: #
  #
  # setup.py
  #
  # Installation script to get setuptools to install pgradd into
  # a Python environment.
  #
  
  import sys
  import setuptools
  
  # Import the lengthy rich-text README as the package's long
  # description:
  with open('README.rst', 'r') as fh:
  	long_description = fh.read()
  
  setuptools_info = {
  	'name': 'pgradd',
  	'version': '1.7',
  	'author': 'Vlachos Research Group',
  	'author_email': 'vlachos@udel.edu',
  	'description': 'Python package implements the Group Additivity (GA) method for estimating thermodynamic properties',
  	'long_description': long_description,
  	'zip_safe': True,
  	'url': 'https://github.com/VlachosGroup/PythonGroupAdditivity',
  	'packages': setuptools.find_packages(),
  	'include_package_data': True,
  	'exclude_package_data': {
  		'': [ 'README.rst', 'docs', 'example', 'tests', 'PKG-INFO', 'LICENSE.md' ]
  	    },
  	'install_requires': [
  		'pmutt>=1.2.5',
  		'scipy>=1.1.0',
  		'numpy>=1.15.1',
  		'IPython>=7.0.0',
  		'PyYAML>=3.0',
  	    ],
  	'dependency_links': [
  		'git+https://github.com/rdkit/rdkit/',
  	    ],
  	'classifiers': [
  		"Programming Language :: Python :: 3",
  		"License :: OSI Approved :: MIT License",
  		"Operating System :: OS Independent",
  		"Intended Audience :: Science/Research",
  		"Topic :: Scientific/Engineering :: Chemistry",
  	    ],
      }
  
  if sys.version_info[0] >= 3:
  	#
  	# Augment for Python 3 setuptools:
  	#
  	setuptools_info['long_description_content_type'] = 'text/x-rst'
  
  setuptools.setup(**setuptools_info)
  
new_contents: #
  #
  # setup.py
  #
  # Installation script to get setuptools to install pgradd into
  # a Python environment.
  #
  
  import sys
  import setuptools
  
  # Import the lengthy rich-text README as the package's long
  # description:
  with open('README.rst', 'r') as fh:
  	long_description = fh.read()
  
  setuptools_info = {
  	'name': 'pgradd',
  	'version': '1.7',
  	'author': 'Vlachos Research Group',
  	'author_email': 'vlachos@udel.edu',
  	'description': 'Python package implements the Group Additivity (GA) method for estimating thermodynamic properties',
  	'long_description': long_description,
  	'zip_safe': True,
  	'url': 'https://github.com/VlachosGroup/PythonGroupAdditivity',
  	'packages': setuptools.find_packages(),
  	'include_package_data': True,
  	'exclude_package_data': {
  		'': [ 'README.rst', 'docs', 'example', 'tests', 'PKG-INFO', 'LICENSE.md' ]
  	    },
  	'install_requires': [
  		'pmutt>=1.2.14',
  		'scipy>=1.1.0',
  		'numpy>=1.15.1',
  		'IPython>=7.0.0',
  		'PyYAML>=3.0',
  	    ],
  	'dependency_links': [
  		'git+https://github.com/rdkit/rdkit/',
  	    ],
  	'classifiers': [
  		"Programming Language :: Python :: 3",
  		"License :: OSI Approved :: MIT License",
  		"Operating System :: OS Independent",
  		"Intended Audience :: Science/Research",
  		"Topic :: Scientific/Engineering :: Chemistry",
  	    ],
      }
  
  if sys.version_info[0] >= 3:
  	#
  	# Augment for Python 3 setuptools:
  	#
  	setuptools_info['long_description_content_type'] = 'text/x-rst'
  
  setuptools.setup(**setuptools_info)
  
subject: Update setup.py