Metadata-Version: 2.1
Name: enumerate-smiles
Version: 0.0.1
Summary: "Enumerate heterocycles, stereoisomers, tautomers and SMILES of molecules."
Home-page: https://github.com/OlivierBeq/enumerate-smiles
Download-URL: https://github.com/OlivierBeq/enumerate-smiles/releases
Author: "Olivier J. M. Béquignon"
Author-email: "olivier.bequignon.maintainer@gmail.com"
Maintainer: "Olivier J. M. Béquignon"
Maintainer-email: "olivier.bequignon.maintainer@gmail.com"
License: MIT
Project-URL: Bug Tracker, https://github.com/OlivierBeq/enumerate-smiles/issues
Project-URL: Source Code, https://github.com/OlivierBeq/enumerate-smiles
Keywords: SMILES,enumeration,cheminformatics,snekpack,cookiecutter
Classifier: Development Status :: 5 - Production/Stable
Classifier: Environment :: Console
Classifier: Intended Audience :: Developers
Classifier: Intended Audience :: Science/Research
Classifier: License :: OSI Approved :: MIT License
Classifier: Operating System :: OS Independent
Classifier: Framework :: Pytest
Classifier: Framework :: tox
Classifier: Framework :: Sphinx
Classifier: Programming Language :: Python
Classifier: Programming Language :: Python :: 3.8
Classifier: Programming Language :: Python :: 3.9
Classifier: Programming Language :: Python :: 3.10
Classifier: Programming Language :: Python :: 3.11
Classifier: Programming Language :: Python :: 3 :: Only
License-File: LICENSE
Requires-Dist: numpy
Requires-Dist: rdkit
Requires-Dist: tqdm
Requires-Dist: bounded-pool-executor ==0.0.3
Requires-Dist: dimorphite-ojmb >=1.2.5-post1
Provides-Extra: docs
Requires-Dist: sphinx <7 ; extra == 'docs'
Requires-Dist: sphinx-rtd-theme ; extra == 'docs'
Requires-Dist: sphinx-autodoc-typehints ; extra == 'docs'
Requires-Dist: sphinx-automodapi ; extra == 'docs'
Provides-Extra: tests
Requires-Dist: pytest ; extra == 'tests'
Requires-Dist: coverage ; extra == 'tests'

