drug-discovery Skill
Pharmaceutical research assistant for drug discovery workflows. Search bioactive compounds on ChEMBL, calculate drug-likeness (Lipinski Ro5, QED, TPSA, synthetic accessibility), look up drug-drug interactions via OpenFDA, interpret ADMET profiles, and assist with lead optimization. Use for medicinal chemistry questions Published by NousResearch in hermes-agent.
What is drug-discovery Skill?
Pharmaceutical research assistant for drug discovery workflows. Search bioactive compounds on ChEMBL, calculate drug-likeness (Lipinski Ro5, QED, TPSA, synthetic accessibility), look up drug-drug interactions via OpenFDA, interpret ADMET profiles, and assist with lead optimization. Use for medicinal chemistry questions Published by NousResearch in hermes-agent. This profile combines repository metadata with install, compatibility, and usage signals so developers can quickly decide whether it fits their agent workflow before opening the source repository.
Automated repository signals based on public metadata such as recency, license, installation evidence, and adoption. These are not a security audit or endorsement.
Key capabilities
- Includes SKILL.md support
- Reusable instructions support
- Database workflows
- Data analysis
- Research
- Database workflows use cases
- Data analysis use cases
Technical details
- Install or run with Copy skill directory
When to use drug-discovery Skill
- Use it for database workflows.
- Use it for data analysis.
- Use it for research.
Built with
Editorial notes
Source
- Creator: NousResearch
- Repository: NousResearch/hermes-agent
- Skill file: optional-skills/research/drug-discovery/SKILL.md
What it does
Pharmaceutical research assistant for drug discovery workflows. Search bioactive compounds on ChEMBL, calculate drug-likeness (Lipinski Ro5, QED, TPSA, synthetic accessibility), look up drug-drug interactions via OpenFDA, interpret ADMET profiles, and assist with lead optimization. Use for medicinal chemistry questions
Skill instructions
Drug Discovery & Pharmaceutical Research You are an expert pharmaceutical scientist and medicinal chemist with deep knowledge of drug discovery, cheminformatics, and clinical pharmacology. Use this skill for all pharma/chemistry research tasks. Core Workflows 1 — Bioactive Compound Search (ChEMBL) Search ChEMBL (the world's largest open bioactivity database) for compounds by target, activity, or molecule name. No API key required. bash Search compounds by target name (e.g. "EGFR", "COX-2", "ACE") TARGET="$1" ENCODED=$(python3 -c "import urllib.parse,sys; print(urllib.parse.quote(sys.argv[1]))" "$TARGET") curl -s "https://www.ebi.ac.uk/chembl/api/data/target/search?q=${ENCODED}&format=json" \ | python3 -c " import json,sys data=json.load(sys.stdin) targets=data.get('targets',[])[:5] for t in targets: print(f"ChEMBL ID : {t.get('targetchemblid')}") print(f"Name : {t.get('prefname')}") print(f"Type : {t.get('targettype')}") print() " bash Get bioactivity data for a ChEMBL target ID
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Frequently asked questions
What is drug-discovery?
drug-discovery is a open-source AI agent skill with Copy skill directory. Pharmaceutical research assistant for drug discovery workflows. Search bioactive compounds on ChEMBL, calculate drug-likeness (Lipinski Ro5, QED, TPSA, synthetic accessibility), look up drug-drug.
Who is drug-discovery best for?
drug-discovery is best for reusing agent instructions, scripts, and references, database workflows, data analysis workflows, research workflows.
How do I install drug-discovery?
Install or run drug-discovery using Copy skill directory. Check drug-discovery for the latest setup command.
Is drug-discovery actively maintained?
drug-discovery may need a closer maintenance check before production use.
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