home/categories/computational-chemistry/ai4protein-venusfactory2-src-agent-skills-chembl-database-skill-md
computational-chemistryresearch
chembl-database
Query ChEMBL bioactive molecules and drug discovery data. Search compounds by structure/properties, retrieve bioactivity data (IC50, Ki), find inhibitors, perform SAR studies, for medicinal chemistry.
maintainer
ai4protein
Mis à jour 3/26/2026
Étoiles
213
Forks
29
quick start
Installation and usage
Query ChEMBL bioactive molecules and drug discovery data. Search compounds by structure/properties, retrieve bioactivity data (IC50, Ki), find inhibitors, perform SAR studies, for medicinal chemistry.
Installation
$ install --globalskills.sh
Utilisation
Après l'installation, vous pouvez utiliser ce skill en exécutant la commande suivante dans votre terminal :
skills use chembl-database