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equilibrator-cheminfo

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Project: equilibrator-cheminfo
Version: 0.15.0
Filename: equilibrator_cheminfo-0.15.0-py3-none-any.whl
Download: [link]
Size: 76644
MD5: 99daf04fb03eb52e6474b50bf737c5fa
SHA256: 158bdc08d077e32f223497fd239f0714b202e54742a3e1c6be141e7303c9f734
Uploaded: 2022-03-19 21:58:45 +0000

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METADATA

Metadata-Version: 2.1
Name: equilibrator-cheminfo
Version: 0.15.0
Summary: Light adapter classes around Open Babel, RDKit, and ChemAxon for the functionality needed in eQulibrator.
Author: Moritz E. Beber, Elad Noor
Author-Email: midnighter[at]posteo.net, eladnoor[at]protonmail.com
Home-Page: https://gitlab.com/equilibrator/equilibrator-cheminfo
Download-Url: https://pypi.org/project/equilibrator-cheminfo/
Project-Url: Source Code, https://gitlab.com/equilibrator/equilibrator-cheminfo
Project-Url: Documentation, https://equilibrator-cheminfo.readthedocs.io
Project-Url: Bug Tracker, https://gitlab.com/equilibrator/equilibrator-cheminfo/issues
License: Apache-2.0
Keywords: cheminformatics,OpenBabel,RDKit,ChemAxon,Marvin
Classifier: Development Status :: 2 - Pre-Alpha
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: Apache Software License
Classifier: Natural Language :: English
Classifier: Operating System :: OS Independent
Classifier: Programming Language :: Python :: 3 :: Only
Classifier: Programming Language :: Python :: 3.8
Classifier: Programming Language :: Python :: 3.9
Classifier: Topic :: Scientific/Engineering :: Bio-Informatics
Classifier: Topic :: Scientific/Engineering :: Chemistry
Requires-Python: >=3.8
Requires-Dist: depinfo (~=1.7)
Requires-Dist: numpy (~=1.17)
Requires-Dist: pandas (~=1.2)
Requires-Dist: sqlalchemy (~=1.4)
Requires-Dist: tqdm (~=4.60)
Requires-Dist: jpype1 (~=1.3); extra == "chemaxon"
Requires-Dist: black; extra == "development"
Requires-Dist: isort; extra == "development"
Requires-Dist: tox; extra == "development"
Requires-Dist: openbabel-wheel (~=3.1); extra == "openbabel"
Requires-Dist: periodictable (~=1.6); extra == "openbabel"
Requires-Dist: rdkit-pypi (~=2021.3); extra == "rdkit"
Provides-Extra: chemaxon
Provides-Extra: development
Provides-Extra: openbabel
Provides-Extra: rdkit
Description-Content-Type: text/x-rst
License-File: LICENSE
[Description omitted; length: 2983 characters]

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