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Graph-based representations of point-cloud data are widely used in data science and machine learning, including epsilon-graphs that contain edges between pairs of data points that are nearer than epsilon and kNN-graphs that connect each…

Algebraic Topology · Mathematics 2022-06-13 Minh Quang Le , Dane Taylor

In graph-based data analysis, $k$-nearest neighbor ($k$NN) graphs are widely used due to their adaptivity to local data densities. Allowing weighted edges in the graph, the kernelized graph affinity provides a more general type of $k$NN…

Machine Learning · Statistics 2026-05-21 Xiuyuan Cheng , Yixuan Tan , Nan Wu

A Shared Nearest Neighbor (SNN) graph is a type of graph construction using shared nearest neighbor information, which is a secondary similarity measure based on the rankings induced by a primary $k$-nearest neighbor ($k$-NN) measure. SNN…

Machine Learning · Statistics 2023-04-04 A. Martina Neuman

Convolutional Neural Networks (CNN) have been successful in processing data signals that are uniformly sampled in the spatial domain (e.g., images). However, most data signals do not natively exist on a grid, and in the process of being…

Computer Vision and Pattern Recognition · Computer Science 2019-01-09 Chiyu "Max" Jiang , Dequan Wang , Jingwei Huang , Philip Marcus , Matthias Nießner

Graph data often exhibits complex geometric heterogeneity, where structures with varying local curvature, such as tree-like hierarchies and dense communities, coexist within a single network. Existing geometric GNNs, which embed graphs into…

Machine Learning · Computer Science 2026-01-21 Xudong Wang , Chris Ding , Tongxin Li , Jicong Fan

We study the discrete-to-continuum consistency of the training of shallow graph convolutional neural networks (GCNNs) on proximity graphs of sampled point clouds under a manifold assumption. Graph convolution is defined spectrally via the…

Machine Learning · Statistics 2026-01-12 Johanna Tengler , Christoph Brune , José A. Iglesias

Convolutional Neural Networks (CNNs) have been applied to data with underlying non-Euclidean structures and have achieved impressive successes. This brings the stability analysis of CNNs on non-Euclidean domains into notice because CNNs…

Signal Processing · Electrical Eng. & Systems 2021-03-05 Zhiyang Wang , Luana Ruiz , Alejandro Ribeiro

Manifold reconstruction has been extensively studied for the last decade or so, especially in two and three dimensions. Recently, significant improvements were made in higher dimensions, leading to new methods to reconstruct large classes…

Computational Geometry · Computer Science 2007-12-18 Frédéric Chazal , Steve Oudot

Recent advances in molecular representation learning have produced highly effective encodings of molecules for numerous cheminformatics and bioinformatics tasks. However, extracting general chemical insight while balancing predictive…

Machine Learning · Computer Science 2025-09-26 Rahul Khorana

The efficiency of extracting topological information from point data depends largely on the complex that is built on top of the data points. From a computational viewpoint, the most favored complexes for this purpose have so far been…

Computational Geometry · Computer Science 2013-04-03 Tamal K. Dey , Fengtao Fan , Yusu Wang

We consider a family of non-compact manifolds $X_\eps$ (``graph-like manifolds'') approaching a metric graph $X_0$ and establish convergence results of the related natural operators, namely the (Neumann) Laplacian $\laplacian {X_\eps}$ and…

Mathematical Physics · Physics 2009-11-11 Olaf Post

Bi-stochastic normalization provides an alternative normalization of graph Laplacians in graph-based data analysis and can be computed efficiently by Sinkhorn-Knopp (SK) iterations. This paper proves the convergence of bi-stochastically…

Statistics Theory · Mathematics 2024-07-19 Xiuyuan Cheng , Boris Landa

Graph Laplacians as well as related spectral inequalities and (co-)homology provide a foray into discrete analogues of Riemannian manifolds, providing a rich interplay between combinatorics, geometry and theoretical physics. We apply some…

Combinatorics · Mathematics 2020-07-01 Yang-Hui He , Shing-Tung Yau

k-nearest neighbor (k-NN) search is a fundamental primitive in geometry processing and computer graphics. While spatial partitioning structures such as kd-trees are standard, they are often manifold-blind, failing to exploit the intrinsic…

Computational Geometry · Computer Science 2026-05-05 Pengfei Wang , Qinghao Guo , Haisen Zhao , Shiqing Xin , Shuangmin Chen , Changhe Tu , Wenping Wang

A standard problem in applied topology is how to discover topological invariants of data from a noisy point cloud that approximates it. We consider the case where a sample is drawn from a properly embedded C1-submanifold without boundary in…

General Topology · Mathematics 2026-03-03 Sara Kalisnik , Davorin Lesnik

Persistent homology is constrained to purely topological persistence while multiscale graphs account only for geometric information. This work introduces persistent spectral theory to create a unified low-dimensional multiscale paradigm for…

Combinatorics · Mathematics 2019-12-13 Rui Wang , Duc Duy Nguyen , Guo-Wei Wei

Topological features based on persistent homology capture high-order structural information so as to augment graph neural network methods. However, computing extended persistent homology summaries remains slow for large and dense graphs and…

Machine Learning · Computer Science 2022-11-16 Zuoyu Yan , Tengfei Ma , Liangcai Gao , Zhi Tang , Yusu Wang , Chao Chen

Graph Neural Networks (GNNs) show impressive performance in many practical scenarios, which can be largely attributed to their stability properties. Empirically, GNNs can scale well on large size graphs, but this is contradicted by the fact…

Signal Processing · Electrical Eng. & Systems 2021-10-12 Zhiyang Wang , Luana Ruiz , Alejandro Ribeiro

Hyperuniform structures are disordered, correlated systems in which density fluctuations are suppressed at large scales. Such a property generalizes the concept of order in patterns and is relevant across diverse physical systems. We…

Soft Condensed Matter · Physics 2025-09-09 Abel H. G. Milor , Otto Sumray , Heather A. Harrington , Axel Voigt , Marco Salvalaglio

Graph convolutional networks (GCNs) are powerful frameworks for learning embeddings of graph-structured data. GCNs are traditionally studied through the lens of Euclidean geometry. Recent works find that non-Euclidean Riemannian manifolds…

Machine Learning · Computer Science 2022-11-10 Bo Xiong , Shichao Zhu , Nico Potyka , Shirui Pan , Chuan Zhou , Steffen Staab
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