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Morgan fingerprints

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04:00
2026-09-22
machinebrief.com
machine-learning

Role-Aware Morgan Fingerprints for Reaction Yield Prediction

Researchers proposed MFP, a reaction yield prediction method built on role-aware Morgan fingerprints that aggregates count-based circular fingerprints by chemical role (reactant, reagent, product) and…

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MFP 1 YieldBERT 1 GNAN 1 Suzuki-Miyaura 1 Buchwald-Hartwig 1 arXiv 1
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