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setup.cfg
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setup.cfg
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[metadata]
name = component-contribution
url = https://github.com/eladnoor/component-contribution
download_url = https://eladnoor.github.io/component-contribution/
author = Elad Noor
author_email = [email protected]
maintainer = Joao Cardoso
maintainer_email = [email protected]
classifiers =
Development Status :: 4 - Beta
Intended Audience :: Science/Research
Topic :: Scientific/Engineering :: Chemistry
License :: OSI Approved :: MIT License
Natural Language :: English
Programming Language :: Python :: 3
Programming Language :: Python :: 3.5
Programming Language :: Python :: 3.6
Programming Language :: Python :: 3.7
license = MIT License
description = Standard reaction Gibbs energy estimation for biochemical reactions.
long_description = file: README.rst
keywords =
component contribution
Gibbs energy
biochemical reaction
[options]
zip_safe = True
install_requires =
importlib_resources
numpy>=1.14.0
scipy>=1.0.0
pandas>=0.23
bioservices>=1.5
openbabel>=2.4.1
equilibrator-cache>=0.1.1
requests
python_requires = >=3.5
tests_require =
tox
packages = find:
package_dir =
= src
[options.packages.find]
where = src
[options.package_data]
component_contribution.data =
*.csv
*.csv.gz
*.tsv
*.tsv.gz
*.json.gz
component_contribution.cache =
*.csv
*.sqlite
*.npz
*.json.gz
[wheel]
universal = 1
[bdist_wheel]
universal = 1
[flake8]
max-line-length = 80
exclude =
__init__.py
docs
[pydocstyle]
match_dir = src/component_contribution
[tool:pytest]
testpaths = tests
[isort]
line_length = 80
indent = 4
multi_line_output = 4
lines_after_imports = 2
known_first_party = component_contribution
known_third_party =
bioservices
importlib_resources
numpy
openbabel
pandas
pybel
pytest
pytest-mock
requests
scipy
equilibrator-cache
# See the docstring in versioneer.py for instructions. Note that you must
# re-run 'versioneer.py setup' after changing this section, and commit the
# resulting files.
[versioneer]
VCS = git
style = pep440
versionfile_source = src/component_contribution/_version.py
versionfile_build = component_contribution/_version.py
tag_prefix =
parentdir_prefix = src/component_contribution-