BBB-Nuke: Transport-Aware Prediction of Blood-Brain Barrier Penetration in Small Molecules
Noah Abasciano, Hamid Hadipour, Abhishek Poddar, Jack Rudrum, Temitope Sobodu
BBB-Nuke predicts blood-brain barrier penetration by integrating physicochemical properties and efflux transporter modeling, achieving high accuracy on benchmark datasets.
bioRxiv · Jul 14, 2026 · PreprintBioengineering