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Nicholas F. Polizzi

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Open access Jun 2026

Zero-shot design of drug-binding proteins via neural iterative selection−expansion

This work used its strategy, termed neural iterative selection–expansion (NISE), to design proteins that, using different folds, specifically bind to two chemically distinct small-molecule drugs, exatecan and apixaban, with success rates of 100%, respectively.

Benjamin Fry, Kaia Slaw, Nicholas F. Polizzi · 7 citations · ⚡1