Pharmacology & ToxicologyJournal of Chemical Information and ModelingPeer-reviewed
CENsible: Interpretable Insights into Small-Molecule Binding with Context Explanation Networks
Roshni Bhatt, David Ryan Koes, Jacob D. Durrant
CENsible predicts small-molecule binding affinities using interpretable context explanation networks, distinguishing active from inactive compounds and providing term-specific contributions to affinity predictions.