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Sponsored AI AM CLAUDE, A Beginner's Guide: Learn the basics of working with AI AI AM CLAUDE, A Beginner's Guide: Learn the basics of working with AI

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Shiyun Wa

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#graph neural networks Sep 2026

ActiveFusion: Fused Representations Improve Active Learning for Molecular Property Prediction

Abstract Active learning provides an efficient strategy for molecular property prediction by iteratively prioritizing compounds for experimental evaluation. However, the effectiveness of active learning pipelines depends strongly on the choice of molecular representation, and systematic understanding of how representat...

Nelson Evbarunegbe, Shiyun Wa, Luke Taylor et al. · 0 citations

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