chemaudit-molecule-validation
chemaudit-molecule-validation is a Chemistry & materials skill for AI agents, published by Kohulan in the ChemAudit repository on GitHub. Skillspace rates chemaudit-molecule-validation D (67/100) and it passed the safety scan; the rating is based on static analysis only.
Validate and score chemical structures using ChemAudit's 16 deep validation checks, 1,500+ structural alerts, and multi-rule drug-likeness scoring. Use when user says "validate this molecule", "check this SMILES", "is this compound valid", "ML-readiness score", "drug-likeness", "deep validation", "quality score", "PAINS check", or asks about stereochemistry, valence, tautomers, or structural issues. Supports SMILES, InChI, MOL blocks, IUPAC names (OPSIN + PubChem), and database identifiers (ChEMBL ID, CAS, PubChem CID, InChIKey) via the /resolve endpoint.
- Grade
- D
- Quality
- 67 / 100
- Safety
- Passed
- GitHub stars
- 64
Unproven: rated by static analysis only, not yet compared head-to-head.
This rating describes the version of the repository we crawled; it may have changed since, so go by its current files.
Our review
- Architecture
- 82 / 100
- Maturity
- Packaged: licensed, with a version or references
- Security scan
- Low-risk patterns
- License
- MIT
- Adoption
- Adopted by 0 other repositories, in 0 collections
What the scanner flagged
- over-broad allowed-tools ('*')
- mentions secrets in text
Not checked yet
- Not judged on the rubric yet (not a contender in its category)
- No blind task eval yet
- Scope (portable / vendor / repo-internal) not assessed; only the top of each category is read for scope
- Sibling files (scripts, references) not fetched; security scan covers SKILL.md only
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