chem-spectrum-matcher
Pass
Audited by Gen Agent Trust Hub on Jun 19, 2026
Risk Level: SAFE
Full Analysis
- [EXTERNAL_DOWNLOADS]: The
match_spectrum.pyscript includes functionality to perform HTTP GET requests tonmrshiftdb.nmr.uni-koeln.de. This is used as a documented fallback to retrieve experimental NMR reference data from a well-known academic repository when local catalog matches are not found. - [COMMAND_EXECUTION]: The skill provides Python scripts (
match_spectrum.py,register_spectrum.py) for processing spectral data and managing a local reference catalog. These scripts operate on numerical data and chemical identifiers (SMILES) using established libraries like RDKit and NumPy, without executing arbitrary shell commands or untrusted code.
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