Explainable Physicochemical Determinants of Protein Ligand Binding via Non-Covalent Interactions www.biorxiv.org/content/10.64898/2026.03...

🚀 New paper: Explainable Physicochemical Determinants of Protein–Ligand Binding via Non-Covalent Interactions

We introduce ExplainBind, an interaction-aware framework that explicitly models non-covalent interactions for explainable protein–ligand binding prediction.

Paper: doi.org/10.64898/202...

Today we have a LLMs +RecSys talk by Jianling Wang from Google Deepmind at our seminar at @irglasgow.bsky.social