home/categories/computational-chemistry/lingxling-awesome-skills-cn-claude-scientific-skills-scientific-skills-pytdc-skill-md
computational-chemistryresearch

pytdc

Therapeutics Data Commons. AI-ready drug discovery datasets (ADME, toxicity, DTI), benchmarks, scaffold splits, molecular oracles, for therapeutic ML and pharmacological prediction.

lingxling
maintainer
lingxling
Mis à jour 3/22/2026
Étoiles
39
Forks
3
quick start

Installation and usage

Therapeutics Data Commons. AI-ready drug discovery datasets (ADME, toxicity, DTI), benchmarks, scaffold splits, molecular oracles, for therapeutic ML and pharmacological prediction.

Installation
$ install --globalskills.sh
Utilisation

Après l'installation, vous pouvez utiliser ce skill en exécutant la commande suivante dans votre terminal :

skills use pytdc