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ChEB-AI
python-chebai-graph
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fix molecule sanitization in reader.py
- #45
#45
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sfluegel05
merged 6 commits into
dev
ChEB-AI/python-chebai-graph:dev
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fix/molecule-sanitization
ChEB-AI/python-chebai-graph:fix/molecule-sanitization
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Aug 3, 2026
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fix molecule sanitization in reader.py
#45
sfluegel05
merged 6 commits into
dev
ChEB-AI/python-chebai-graph:dev
from
fix/molecule-sanitization
ChEB-AI/python-chebai-graph:fix/molecule-sanitization
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Commits
Commits on Aug 3, 2026
use sanitized molecule
sfluegel05
committed
d856b2c
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remove broken assertion
sfluegel05
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31e6613
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use smiles_to_mol function from chebi_utils
sfluegel05
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e3f40bc
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swap molecule sanitization for complete SMILES parsing
sfluegel05
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a805f97
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Merge branch 'dev' into fix/molecule-sanitization
sfluegel05
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83eb080
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add chebi utils
sfluegel05
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427e6de
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