TeachOpenCADD Workflow 1: Data acquisition from ChEMBL

Information on compound structure, bioactivity, and associated targets are organized in databases such as ChEMBL, PubChem, or DrugBank. This workflow shows how to obtain and preprocess data for a query target (default target: EGFR) from the ChEMBL web services.

This is a companion discussion topic for the original entry at https://kni.me/w/qwaXNzTSNG0rdM7d