home/categories/scientific-computing/spectrai-initiative-innoclaw-claude-skills-smiles-comprehensive-analysis-skill-md
scientific-computingresearch
smiles-comprehensive-analysis
SMILES Comprehensive Analysis - Comprehensive SMILES analysis: validate, convert name, compute all molecular descriptors, and predict ADMET. Use this skill for cheminformatics tasks involving is valid smiles ChemicalStructureAnalyzer calculate mol basic info pred molecule admet. Combines 4 tools from 3 SCP server(s).
maintainer
SpectrAI-Initiative
Mis à jour 4/2/2026
Étoiles
371
Forks
23
quick start
Installation and usage
SMILES Comprehensive Analysis - Comprehensive SMILES analysis: validate, convert name, compute all molecular descriptors, and predict ADMET. Use this skill for cheminformatics tasks involving is valid smiles ChemicalStructureAnalyzer calculate mol basic info pred molecule admet. Combines 4 tools from 3 SCP server(s).
Installation
$ install --globalskills.sh
Utilisation
Après l'installation, vous pouvez utiliser ce skill en exécutant la commande suivante dans votre terminal :
skills use smiles-comprehensive-analysis