#proteinligandbindingaffinity

GitHub - THGLab/HiQBind: Workflow to clean up and fix structural problems in protein-ligand binding datasets Workflow to clean up and fix structural problems in protein-ligand binding datasets - THGLab/HiQBind

Check it out, and feel free to drop your questions here or on GitHub!
🔗 GitHub: github.com/THGLab/HiQBind
📄 Paper: pubs.rsc.org/en/content/a...

#machinelearning #proteinligand #proteinligandbindingaffinity #structuralbiology #ai4sci