skills.homes logoskills.homescapability registry
home/categories/computational-chemistry/spectrai-initiative-innoclaw-claude-skills-drugsda-drug-likeness-skill-md
cd ..
computational-chemistryresearch

drugsda-drug-likeness

Compute the drug-likeness metrics (QED score and Number of violations of Lipinski's Rule of Five) of the input candidate molecules (SMILES format).

Ver código-fontecomputational-chemistry
SpectrAI-Initiative
maintainer
SpectrAI-Initiative
Atualizado 4/2/2026
Estrelas
371
Forks
23
quick start

Installation and usage

Compute the drug-likeness metrics (QED score and Number of violations of Lipinski's Rule of Five) of the input candidate molecules (SMILES format).

Instalação
$ install --globalskills.sh
Uso

Depois de instalar, você pode usar esta skill executando o seguinte comando no terminal:

skills use drugsda-drug-likeness