home/categories/computational-chemistry/jiaxiaojunqaq-skillject-data-skills-sample-chembl-database-skill-md
computational-chemistryresearch
chembl-database
Query ChEMBL's 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
jiaxiaojunQAQ
Atualizado 2/25/2026
Estrelas
47
Forks
3
quick start
Installation and usage
Query ChEMBL's bioactive molecules and drug discovery data. Search compounds by structure/properties, retrieve bioactivity data (IC50, Ki), find inhibitors, perform SAR studies, for medicinal chemistry.
Instalação
$ install --globalskills.sh
Uso
Depois de instalar, você pode usar esta skill executando o seguinte comando no terminal:
skills use chembl-database