LICENSE
README.md
pyproject.toml
src/chemdatacheck/__init__.py
src/chemdatacheck/__main__.py
src/chemdatacheck/cli.py
src/chemdatacheck/io.py
src/chemdatacheck/models.py
src/chemdatacheck/molecules.py
src/chemdatacheck/report.py
src/chemdatacheck/scoring.py
src/chemdatacheck.egg-info/PKG-INFO
src/chemdatacheck.egg-info/SOURCES.txt
src/chemdatacheck.egg-info/dependency_links.txt
src/chemdatacheck.egg-info/entry_points.txt
src/chemdatacheck.egg-info/requires.txt
src/chemdatacheck.egg-info/top_level.txt
src/chemdatacheck/checks/__init__.py
src/chemdatacheck/checks/duplicates.py
src/chemdatacheck/checks/integrity.py
src/chemdatacheck/checks/ml.py
src/chemdatacheck/checks/space.py
src/chemdatacheck/checks/splits.py
tests/test_duplicates.py
tests/test_edge_cases.py
tests/test_integrity.py
tests/test_io_reporters.py
tests/test_splits_ml_space.py
tests/test_validation_snapshots.py