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We propose an end-to-end deep learning learning model for graph classification and representation learning that is invariant to permutation of the nodes of the input graphs. We address the challenge of learning a fixed size graph…

Machine Learning · Computer Science 2019-05-09 Peter Meltzer , Marcelo Daniel Gutierrez Mallea , Peter J. Bentley

In deep learning, it is common to use more network parameters than training points. In such scenarioof over-parameterization, there are usually multiple networks that achieve zero training error so that thetraining algorithm induces an…

Machine Learning · Computer Science 2023-08-22 Hung-Hsu Chou , Carsten Gieshoff , Johannes Maly , Holger Rauhut

Machine learning frameworks such as graph neural networks typically rely on a given, fixed graph to exploit relational inductive biases and thus effectively learn from network data. However, when said graphs are (partially) unobserved,…

Machine Learning · Computer Science 2022-05-20 Max Wasserman , Saurabh Sihag , Gonzalo Mateos , Alejandro Ribeiro

Abstract notions of convexity over the vertices of a graph, and corresponding notions of halfspaces, have recently gained attention from the machine learning community. In this work we study monophonic halfspaces, a notion of graph…

Machine Learning · Computer Science 2025-07-01 Marco Bressan , Victor Chepoi , Emmanuel Esposito , Maximilian Thiessen

A hallmark of graph neural networks is their ability to distinguish the isomorphism class of their inputs. This study derives hardness results for the classification variant of graph isomorphism in the message-passing model (MPNN). MPNN…

Machine Learning · Computer Science 2020-10-19 Andreas Loukas

The present phase of Machine Learning is characterized by supervised learning algorithms relying on large sets of labeled examples ($n \to \infty$). The next phase is likely to focus on algorithms capable of learning from very few labeled…

Computer Vision and Pattern Recognition · Computer Science 2014-03-12 Fabio Anselmi , Joel Z. Leibo , Lorenzo Rosasco , Jim Mutch , Andrea Tacchetti , Tomaso Poggio

Modern deep learning models generalize remarkably well in-distribution, despite being overparametrized and trained with little to no explicit regularization. Instead, current theory credits implicit regularization imposed by the choice of…

Machine Learning · Computer Science 2026-03-17 Jonathan Wenger , Beau Coker , Juraj Marusic , John P. Cunningham

Implicit Graph Neural Networks (GNNs) have achieved significant success in addressing graph learning problems recently. However, poorly designed implicit GNN layers may have limited adaptability to learn graph metrics, experience…

Machine Learning · Computer Science 2024-02-16 Guoji Fu , Mohammed Haroon Dupty , Yanfei Dong , Lee Wee Sun

With the wide-spread availability of complex relational data, semi-supervised node classification in graphs has become a central machine learning problem. Graph neural networks are a recent class of easy-to-train and accurate methods for…

Machine Learning · Computer Science 2021-06-08 Junteng Jia , Cenk Baykal , Vamsi K. Potluru , Austin R. Benson

We study the implicit bias of gradient flow on linear equivariant steerable networks in group-invariant binary classification. Our findings reveal that the parameterized predictor converges in direction to the unique group-invariant…

Machine Learning · Computer Science 2023-05-08 Ziyu Chen , Wei Zhu

Exploiting data invariances is crucial for efficient learning in both artificial and biological neural circuits. Understanding how neural networks can discover appropriate representations capable of harnessing the underlying symmetries of…

Disordered Systems and Neural Networks · Physics 2022-10-17 Alessandro Ingrosso , Sebastian Goldt

In this work, we formally prove that, under certain conditions, if a neural network is invariant to a finite group then its weights recover the Fourier transform on that group. This provides a mathematical explanation for the emergence of…

Machine Learning · Computer Science 2024-06-17 Giovanni Luca Marchetti , Christopher Hillar , Danica Kragic , Sophia Sanborn

Due to the over-smoothing issue, most existing graph neural networks can only capture limited dependencies with their inherently finite aggregation layers. To overcome this limitation, we propose a new kind of graph convolution, called…

Machine Learning · Computer Science 2022-06-30 Qi Chen , Yifei Wang , Yisen Wang , Jiansheng Yang , Zhouchen Lin

Recently a variety of methods have been developed to encode graphs into low-dimensional vectors that can be easily exploited by machine learning algorithms. The majority of these methods start by embedding the graph nodes into a…

Machine Learning · Computer Science 2018-09-13 Yu Jin , Joseph F. JaJa

Many supervised learning problems involve high-dimensional data such as images, text, or graphs. In order to make efficient use of data, it is often useful to leverage certain geometric priors in the problem at hand, such as invariance to…

Machine Learning · Statistics 2021-11-08 Alberto Bietti , Luca Venturi , Joan Bruna

Modern machine learning increasingly leverages the insight that high-dimensional data often lie near low-dimensional, non-linear manifolds, an idea known as the manifold hypothesis. By explicitly modeling the geometric structure of data…

Machine Learning · Computer Science 2026-03-02 Willem Diepeveen , Deanna Needell

The Hopfield recurrent neural network is a classical auto-associative model of memory, in which collections of symmetrically-coupled McCulloch-Pitts neurons interact to perform emergent computation. Although previous researchers have…

Adaptation and Self-Organizing Systems · Physics 2015-06-09 Christopher Hillar , Ngoc M. Tran

This paper introduces a novel unsupervised learning paradigm inspired by Gerald Edelman's theory of neuronal group selection ("Neural Darwinism"). The presented automaton learns to recognize arbitrary symbols (e.g., letters of an alphabet)…

Neural and Evolutionary Computing · Computer Science 2023-12-01 Mario Stepanik

Equivariant neural networks have proven to be effective for tasks with known underlying symmetries. However, optimizing equivariant networks can be tricky and best training practices are less established than for standard networks. In…

Machine Learning · Computer Science 2025-11-04 YuQing Xie , Tess Smidt

Topological invariants allow to characterize Hamiltonians, predicting the existence of topologically protected in-gap modes. Those invariants can be computed by tracing the evolution of the occupied wavefunctions under twisted boundary…

Mesoscale and Nanoscale Physics · Physics 2018-04-04 D. Carvalho , N. A. Garcia-Martinez , J. L. Lado , J. Fernandez-Rossier