standardize-chemical-structures
离线批量解析、标准化、去盐、提取 parent、检查异常并按原始/标准化/parent 结构分组。用于清洗 SMILES、CSV、SDF、MolBlock，检查价态/立体化学/混合物，或为描述符、相似性检索和建模准备结构数据。
Pinned to revision b943185fae20, so it is the text this page describes rather than whatever the author pushed since.
Files
- skills/standardize-chemical-structures/SKILL.md
- skills/standardize-chemical-structures/agents/openai.yaml
- skills/standardize-chemical-structures/references/输入输出与标准化边界.md
- skills/standardize-chemical-structures/scripts/requirements.txt
- skills/standardize-chemical-structures/scripts/standardization_output_contract.py
- skills/standardize-chemical-structures/scripts/standardize_structures.py
- skills/standardize-chemical-structures/scripts/validate_output.py
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