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arXiv:cs.LG(机器学习,全量分类)· Caleb Stam, Aagrim Hoysal, Sanjukta Krishnagopal·· 14 小时前AI 评分34

高阶位置编码为图表示学习引入拓扑信息

Higher-Order Positional Encodings for Graph Representation Learning

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研究者提出一种高阶位置编码范式,通过从团复形导出的 Hodge Laplacian 为图表示注入高阶拓扑信息,使标准图学习模型无需修改主干即可利用提升后的关联结构。理论证明高阶提升诱导的节点级算子能以标量图谱滤波器无法实现的方式混合图 Laplacian 频率。在 ZINC 和受控合成基准上,Graph Transformer 的预测性能获得提升。

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Abstract:Many real-world systems exhibit higher-order interactions among groups of entities that cannot be captured by pairwise relationships alone. Graph Transformers and Graph Neural Networks increasingly rely on positional encodings to enrich graph representations, yet existing positional encodings are computed solely from the original graph and therefore cannot directly capture observed higher-order interactions. Topological Deep Learning addresses this limitation by lifting graphs to simplicial complexes, but typically requires performing message passing or attention on higher-order neural network representations. We introduce a representation learning paradigm that enriches graph representations with higher-order topology through positional encodings, enabling standard graph learning models to exploit lifted incidence structure without modifying the backbone. We derive a theoretical characterization of the expressivity of higher-order positional encodings, proving that node-level operators induced by higher-order lifts can mix graph Laplacian frequencies in ways that scalar graph spectral filters cannot. Guided by this theory, we instantiate higher-order positional encodings using Hodge Laplacians derived from clique complexes. Experiments with Graph Transformers on ZINC and controlled synthetic benchmarks demonstrate improvements in predictive performance, while a fixed-1-skeleton experiment shows that the pipeline can transmit higher-order information when cells are supplied independently of the graph. Together, our results establish higher-order positional encodings as a principled bridge between graph positional encodings and topological deep learning.
Comments: Accepted at the Fifth Learning on Graphs Conference (LoG 2026)
Subjects: Machine Learning (cs.LG)
Cite as: arXiv:2610.01903 [cs.LG]
  (or arXiv:2610.01903v1 [cs.LG] for this version)
  https://doi.org/10.48550/arXiv.2610.01903

arXiv-issued DOI via DataCite (pending registration)

Submission history

From: Caleb Stam [view email]
[v1] Thu, 1 Oct 2026 15:49:18 UTC (216 KB)

来源:arXiv:cs.LG(机器学习,全量分类) · arxiv.org