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Fused Gromov-Wasserstein Contrastive Learning for Effective Enzyme-Reaction Screening

arXiv:2512.08508v1 Announce Type: cross Abstract: Enzymes are crucial catalysts that enable a wide range of biochemical reactions. Efficiently identifying specific enzymes from vast protein libraries is essential for advancing biocatalysis. Traditional computational methods for enzyme screening and retrieval are time-consuming…

Softly Symbolifying Kolmogorov-Arnold Networks

arXiv:2512.07875v1 Announce Type: new Abstract: Kolmogorov-Arnold Networks (KANs) offer a promising path toward interpretable machine learning: their learnable activations can be studied individually, while collectively fitting complex data accurately. In practice, however, trained activations often lack symbolic fidelity, learning pathological…

Graph Contrastive Learning via Spectral Graph Alignment

arXiv:2512.07878v1 Announce Type: new Abstract: Given augmented views of each input graph, contrastive learning methods (e.g., InfoNCE) optimize pairwise alignment of graph embeddings across views while providing no mechanism to control the global structure of the view specific graph-of-graphs built…