Toxicity prediction (hERG / DILI) / 毒性预测(hERG/DILI)
toxicity_predictToxicity prediction (hERG / DILI) / 毒性预测(hERG/DILI) | USE WHEN: cardiac (hERG) and liver (DILI) toxicity risk from a SMILES string | ALIASES: 毒性预测, hERG, DILI, 心脏毒性, 肝毒性, toxicity, SMILES | RETURNS: 毒性风险分级
Input Schema
| Name | Required | Description | Default |
|---|---|---|---|
| smiles | Yes | 化合物 SMILES | |
| endpoints | No | 终点:hERG/DILI/Ames |