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feat(validation): export validation module from package

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lingyuzeng
2026-03-19 10:32:05 +08:00
parent dc2812842e
commit a9052bbf89
1 changed files with 9 additions and 0 deletions
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9
src/macro_lactone_toolkit/__init__.py
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@@ -36,8 +36,10 @@ __all__ = [
"MacrolactoneDetectionError", "MacrolactoneDetectionError",
"MacrolactoneError", "MacrolactoneError",
"MacrolactoneFragmenter", "MacrolactoneFragmenter",
"MacrolactoneValidator",
"MacrocycleClassificationResult", "MacrocycleClassificationResult",
"numbered_molecule_svg", "numbered_molecule_svg",
"ParentMolecule",
"RingNumberingError", "RingNumberingError",
"RingNumberingResult", "RingNumberingResult",
"results_to_dataframe", "results_to_dataframe",
@@ -48,4 +50,11 @@ __all__ = [
"write_result_json", "write_result_json",
] ]
# Validation module (optional import)
try:
from .validation.validator import MacrolactoneValidator
from .validation.models import ParentMolecule, SideChainFragment
except ImportError:
pass # SQLModel not installed
__version__ = "0.1.0" __version__ = "0.1.0"