arXiv Machine Learning

Higher-Order Positional Encodings for Graph Representation Learning

The paper introduces higher-order positional encodings that enrich graph representations by incorporating topological information from lifted incidence structures, without altering existing graph learning backbones. It theoretically shows that these encodings can mix graph Laplacian frequencies beyond what scalar spectral filters achieve, and demonstrates their effectiveness on Graph Transformers for datasets like ZINC and synthetic benchmarks. The approach bridges graph positional encodings and topological deep learning, enabling standard models to exploit higher-order interactions.

arXiv Machine Learning
Jun 5

HOPSE: Scalable Higher-Order Positional and Structural Encoder for Combinatorial Representations

arXiv:2505. 15405v3 Announce Type: replace Abstract: While Graph Neural Networks (GNNs) have proven highly effective at modeling relational data, pairwise connections cannot fully capture multi-way relationships naturally present in complex real-world systems.

By Guillermo Bern\'ardez, Marco Montagna, Louis Van Langendonck, Martin Carrasco, Amirreza Akbari, Louisa Cornelis, Mathilde Papillon, Pere Barlet-Ros, Nina Miolane, Lev Telyatnikov
Hugging Face Trending Papers
Sep 8

Topology-induced Operators Reveal Complementary Graph Representations without Training

The paper demonstrates that high‑quality graph embeddings can be produced without complex models or training by propagating random features through topological structures derived from random walks and anonymous walks. These training‑free embeddings capture node proximity and structural roles, respectively, and perform competitively on node, edge, and graph tasks while often requiring less computation. Combining the two embedding types further improves inference quality for some tasks.

arXiv Machine Learning
Aug 19

HyPE-GT: where Graph Transformers meet Hyperbolic Positional Encodings

HyPE-GT introduces a framework that generates learnable hyperbolic positional encodings for Graph Transformers, enabling the capture of complex hierarchical relationships in graph-structured data. Unlike traditional Euclidean encodings, HyPE’s hyperbolic encodings can be selected to suit specific downstream tasks and help mitigate oversmoothing in deep Graph Neural Networks. Experiments on molecular benchmarks and large-scale Open Graph Benchmark datasets demonstrate improved performance, while additional tests on Coauthor and Copurchase networks confirm HyPE’s effectiveness in controlling oversmoothing.

By Kushal Bose, Swagatam Das
arXiv Machine Learning
Jun 16

Graph Learning Should Move Beyond Restrictive Views of Spectral and Message-Passing GNNs

arXiv:2602. 10031v2 Announce Type: replace Abstract: Graph neural networks (GNNs) are commonly divided into message-passing neural networks (MPNNs) and spectral GNNs, reflecting two largely separate research traditions in machine learning and signal processing.

By Antonis Vasileiou, Juan Cervino, Pascal Frossard, Charilaos I. Kanatsoulis, Christopher Morris, Michael T. Schaub, Pierre Vandergheynst, Zhiyang Wang, Guy Wolf, Ron Levie
arXiv AI
Jul 28

A Survey of Graph Transformers: Architectures, Theories and Applications

arXiv:2502. 16533v3 Announce Type: replace-cross Abstract: Graph Transformers (GTs) have demonstrated a strong capability in modeling graph structures by addressing the intrinsic limitations of graph neural networks (GNNs), such as over-smoothing and over-squashing.

By Chaohao Yuan, Kangfei Zhao, Ercan Engin Kuruoglu, Liang Wang, Tingyang Xu, Wenbing Huang, Deli Zhao, Hong Cheng, Yu Rong