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rxn-metrics

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1.1.0 rxn_metrics-1.1.0-py3-none-any.whl

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Project: rxn-metrics
Version: 1.1.0
Filename: rxn_metrics-1.1.0-py3-none-any.whl
Download: [link]
Size: 27544
MD5: 6f56baf070d833b3bf663529758975fd
SHA256: 8b770e952c2cb3c45a1ffaffc27c6470c6cf75e5d44c743c987c60bf93e6aa42
Uploaded: 2023-08-02 13:00:29 +0000

dist-info

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

METADATA

Metadata-Version: 2.1
Name: rxn-metrics
Version: 1.1.0
Summary: Metrics for RXN models
Author: IBM RXN team
Home-Page: https://github.com/rxn4chemistry/rxn-metrics
Project-Url: Documentation, https://rxn4chemistry.github.io/rxn-metrics/
Project-Url: Repository, https://github.com/rxn4chemistry/rxn-metrics
License: MIT
Classifier: Operating System :: OS Independent
Classifier: Programming Language :: Python :: 3
Classifier: Programming Language :: Python :: 3.6
Classifier: Programming Language :: Python :: 3.7
Classifier: Programming Language :: Python :: 3.8
Requires-Python: >=3.6
Requires-Dist: click (>=8.0)
Requires-Dist: pandas (>=1.1.0)
Requires-Dist: rxn-chem-utils (>=1.3.0)
Requires-Dist: rxn-onmt-models (>=1.0.0)
Requires-Dist: rxn-onmt-utils (>=1.0.0)
Requires-Dist: rxn-utils (>=1.1.9)
Requires-Dist: black (>=22.3.0); extra == "dev"
Requires-Dist: bump2version (>=1.0.1); extra == "dev"
Requires-Dist: flake8 (>=3.8.4); extra == "dev"
Requires-Dist: isort (>=5.10.1); extra == "dev"
Requires-Dist: mypy (>=0.910); extra == "dev"
Requires-Dist: pytest (>=5.3.4); extra == "dev"
Requires-Dist: types-setuptools (>=57.4.14); extra == "dev"
Requires-Dist: rdkit-pypi (>=2021.3.2); python_version < "3.7" and extra == "rdkit"
Requires-Dist: rdkit (>=2022.3.4); python_version >= "3.7" and extra == "rdkit"
Requires-Dist: rxnmapper (>=0.3.0); extra == "rxnmapper"
Requires-Dist: transformers (<4.23.0); extra == "rxnmapper"
Provides-Extra: dev
Provides-Extra: rdkit
Provides-Extra: rxnmapper
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 2422 characters]

WHEEL

Wheel-Version: 1.0
Generator: bdist_wheel (0.41.0)
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

Path Digest Size
rxn/metrics/__init__.py sha256=1S7KTbsP2g2SujcIgg3DcW7NXW14x57Y_IzF0rvBk0E 191
rxn/metrics/class_tokens.py sha256=vUJu4-6dHGvx9gsU83G1jKlkU97kHfeJDT_2UD1aTBw 1200
rxn/metrics/classification_translation.py sha256=dpKvq92lYwd1vXH-S7WuZpPzBtDoeddq805xmThGLJ4 3846
rxn/metrics/context_metrics.py sha256=ybD7BQfKgs60-rNnwoIKExMhbLJDelEAhjzLQHa8a9g 4164
rxn/metrics/forward_metrics.py sha256=XG8fKGRGlHxvS717pVPYSt0b06m02ohWFa1cGkoB8YU 1624
rxn/metrics/metrics.py sha256=ptbhvClNZKr9OpLK1vNr8HCT4__4CzNZc_6doXuXrLk 6180
rxn/metrics/metrics_calculator.py sha256=pmmL3Pose8Gq2GSSWShtpHUM_RJ_8l0d3h-omeYJLRY 742
rxn/metrics/metrics_files.py sha256=BqDepEkg4An8bUJ5KZrcsv5VAiXecOaPKqNO93cMJxE 3187
rxn/metrics/py.typed sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
rxn/metrics/retro_metrics.py sha256=crNgODITDRIUpZYuj8LTqZ0GbgrSjwjcHzJ6FRS2t8s 5650
rxn/metrics/run_metrics.py sha256=cUFY8aLbEaVTWHJXjjlio2cIbWEAnz5Fb83vM0LemhM 2856
rxn/metrics/tokenize_file.py sha256=oxZ_zv-7yn_oqyT9049C9I1qxr7t-4CU17-6U52ORf8 4455
rxn/metrics/true_reactant_accuracy.py sha256=_o0EbT5bsqD1kK7V7fINmUQ1ATUejxEWxrOz1p9R_m4 5373
rxn/metrics/utils.py sha256=pTt_Xqoz8JOc6EJFkc7Ijk3dKtbae7SURYHtf2zk_mM 2360
rxn/metrics/scripts/__init__.py sha256=O25Cx-ypACGtQdeBwgdYc-wNtTfxbQmYphmzBvggNPo 141
rxn/metrics/scripts/ensure_data_dimension.py sha256=Ywq4zsatYDSD6aJx9iDMvyJTScwDHvJxarfirpA0lD8 2689
rxn/metrics/scripts/join_data_files.py sha256=vUphGnyigYJJLx5prvEYyFECxlTsRAI0hrLS4fDuyTs 2647
rxn/metrics/scripts/parse_metrics_into_csv.py sha256=B1MrtK-xmbhCRUVvrbHY9EoUQUX4KdyfBDp_51icIR4 1380
rxn/metrics/scripts/prepare_context_metrics.py sha256=bZiH8nZVGs1sjJIZgsoRBg-MbocFg4xCKfBnt9enQ08 1916
rxn/metrics/scripts/prepare_forward_metrics.py sha256=2DAPwftBFtZ6Q43aK0OIIiKHDTkX-mNFEcrQwJ5p5us 1930
rxn/metrics/scripts/prepare_retro_metrics.py sha256=RCYFnHkkOdT0h9ydiAM-J8WEu1Pvb7rRK2UIx000HHU 5192
rxn/metrics/scripts/reorder_retro_predictions_class_token.py sha256=4Jvh4l78P7MPAD6dDyFFUQIzuW9njGPozAZxlSgX_Q4 5596
rxn/metrics/scripts/rxn_evaluate_metrics.py sha256=0eoFqydDAJFRIqcQP3j7RUELOBcB1vzWU1PNk31eBv8 615
rxn_metrics-1.1.0.dist-info/LICENSE sha256=pUTytnvKTKWldF5SZdIghDq8bRH9mZX-yBQ8OBpj5SM 1070
rxn_metrics-1.1.0.dist-info/METADATA sha256=6cZQnbMgFeHDU1Ld-iFjzxrVbdIed_sZ2NbfbcKJaTo 4006
rxn_metrics-1.1.0.dist-info/WHEEL sha256=AtBG6SXL3KF_v0NxLf0ehyVOh0cold-JbJYXNGorC6Q 92
rxn_metrics-1.1.0.dist-info/entry_points.txt sha256=8uP7AIYiu2kBeuJ4B40zoNy2fgkfrd47WvjwL8qVorI 397
rxn_metrics-1.1.0.dist-info/top_level.txt sha256=1k4ww_NEi3l5UGgHZQ-bcD-eona7vmT8VkQtodGkca8 4
rxn_metrics-1.1.0.dist-info/RECORD — —

top_level.txt

rxn

entry_points.txt

[console_scripts]
rxn-evaluate-metrics = rxn.metrics.scripts.rxn_evaluate_metrics:main
rxn-parse-metrics-into-csv = rxn.metrics.scripts.parse_metrics_into_csv:main
rxn-prepare-context-metrics = rxn.metrics.scripts.prepare_context_metrics:main
rxn-prepare-forward-metrics = rxn.metrics.scripts.prepare_forward_metrics:main
rxn-prepare-retro-metrics = rxn.metrics.scripts.prepare_retro_metrics:main