Quantum-informed hops yield sub-μM natural-product α-glucosidase hits

Apr 8, 2026Sources

Featured receives full write-ups, Notable gets short mentions, and Candidate remains visible for manual review instead of being hidden.

Featured1Notable3Candidate52

Featured

Is scaffold hopping possible in machine learning using the electronic-structure-informatics (ESI) descriptor set? an application to natural-product-based drug discovery of α-glucosidase inhibitors.
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Peer-reviewed journal source; Core venue: Journal of Cheminformatics; Domain relevant (2 hits): drug discovery, scaffold hopping; AIDD core boost (2 hits): drug discovery, scaffold hopping; Priority topic: molecule design

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