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rxn-reaction-preprocessing

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2.4.0 rxn_reaction_preprocessing-2.4.0-py3-none-any.whl

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Project: rxn-reaction-preprocessing
Version: 2.4.0
Filename: rxn_reaction_preprocessing-2.4.0-py3-none-any.whl
Download: [link]
Size: 97710
MD5: 688a1cdfaec8edd6aa24bbd14f9b669b
SHA256: 10609e1a6824bfa6b6e93e090c96a73b3380b45ee73f15fc3e027c3d08deebc6
Uploaded: 2023-09-18 09:21:04 +0000

dist-info

METADATA · WHEEL · RECORD · top_level.txt · entry_points.txt

METADATA

Metadata-Version: 2.1
Name: rxn-reaction-preprocessing
Version: 2.4.0
Summary: Reaction preprocessing tools
Author: IBM RXN team
Author-Email: rxn4chemistry[at]zurich.ibm.com
Home-Page: https://github.com/rxn4chemistry/rxn-reaction-preprocessing
Project-Url: Documentation, https://rxn4chemistry.github.io/rxn-reaction-preprocessing/
Project-Url: Repository, https://github.com/rxn4chemistry/rxn-reaction-preprocessing
License: MIT
Classifier: Intended Audience :: Developers
Classifier: Intended Audience :: Science/Research
Classifier: Programming Language :: Python :: 3
Classifier: Programming Language :: Python :: 3.7
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: Topic :: Software Development :: Libraries :: Python Modules
Requires-Python: >=3.7
Requires-Dist: attrs (>=21.2.0)
Requires-Dist: click (>=7.1.2)
Requires-Dist: hydra-core (>=1.1.0)
Requires-Dist: numpy (>=1.16.5)
Requires-Dist: pandas (>=1.1.1)
Requires-Dist: rxn-chem-utils (>=1.0.4)
Requires-Dist: rxn-utils (>=1.5.0)
Requires-Dist: tabulate (>=0.8.7)
Requires-Dist: xxhash (>=2.0.0)
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Requires-Dist: isort (>=5.9.3); extra == "dev"
Requires-Dist: mypy (>=0.950); extra == "dev"
Requires-Dist: pre-commit (>=2.9.2); extra == "dev"
Requires-Dist: pylint (>=2.6.0); extra == "dev"
Requires-Dist: pytest-cov (>=2.10.1); extra == "dev"
Requires-Dist: pytest (>=6.1.2); extra == "dev"
Requires-Dist: types-click (>=7.1.1); extra == "dev"
Requires-Dist: types-dataclasses (>=0.1.4); extra == "dev"
Requires-Dist: types-setuptools (>=57.4.2); extra == "dev"
Requires-Dist: types-tabulate (>=0.1.0); extra == "dev"
Requires-Dist: rdkit (>=2022.3.3); extra == "rdkit"
Provides-Extra: dev
Provides-Extra: rdkit
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 4426 characters]

WHEEL

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rxn_reaction_preprocessing-2.4.0.dist-info/RECORD — —

top_level.txt

rxn

entry_points.txt

[console_scripts]
rxn-combine-class-token = rxn.reaction_preprocessing.scripts.combine_class_token:main
rxn-data-pipeline = rxn.reaction_preprocessing.main:data_pipeline
rxn-standardize-pistachio-records = rxn.reaction_preprocessing.scripts.standardize_pistachio_records:main