Digital Twin Approaches for Interpretable Side Effect Prediction in Drug Discovery
András Ecker, Gergely Szabó, János Szalma, Erzsébet Fichó, Istvan Zoltan Reguly, Attila Csikász-Nagy
This paper proposes a digital twin-based model for interpretable side effect prediction in drug discovery using off-target proteins and biophysical mechanisms, offering actionable insights.
Drug Discovery Today · Mar 10, 2026Peer-reviewedPharmacology & Toxicology