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Spatial networks are networks whose graph topology is constrained by their embedded spatial space. Understanding the coupled spatial-graph properties is crucial for extracting powerful representations from spatial networks. Therefore,…

Machine Learning · Computer Science 2024-01-11 Zheng Zhang , Sirui Li , Jingcheng Zhou , Junxiang Wang , Abhinav Angirekula , Allen Zhang , Liang Zhao

In traditional software programs, it is easy to trace program logic from variables back to input, apply assertion statements to block erroneous behavior, and compose programs together. Although deep learning programs have demonstrated…

Machine Learning · Computer Science 2021-10-27 Mike Wu , Noah Goodman , Stefano Ermon

PDE-based Group Convolutional Neural Networks (PDE-G-CNNs) use solvers of evolution PDEs as substitutes for the conventional components in G-CNNs. PDE-G-CNNs can offer several benefits simultaneously: fewer parameters, inherent…

Machine Learning · Computer Science 2024-11-21 Gijs Bellaard , Sei Sakata , Bart M. N. Smets , Remco Duits

Feature descriptors play a crucial role in a wide range of geometry analysis and processing applications, including shape correspondence, retrieval, and segmentation. In this paper, we introduce Geodesic Convolutional Neural Networks…

Computer Vision and Pattern Recognition · Computer Science 2018-06-11 Jonathan Masci , Davide Boscaini , Michael M. Bronstein , Pierre Vandergheynst

Recently, graph neural networks (GNNs) have proved to be suitable in tasks on unstructured data. Particularly in tasks as community detection, node classification, and link prediction. However, most GNN models still operate with static…

Machine Learning · Computer Science 2019-06-07 Darwin Saire Pilco , Adín Ramírez Rivera

We explain equivariant neural networks, a notion underlying breakthroughs in machine learning from deep convolutional neural networks for computer vision to AlphaFold 2 for protein structure prediction, without assuming knowledge of…

Machine Learning · Computer Science 2022-11-18 Lek-Heng Lim , Bradley J. Nelson

Neural networks are powerful function estimators, leading to their status as a paradigm of choice for modeling structured data. However, unlike other structured representations that emphasize the modularity of the problem -- e.g., factor…

Machine Learning · Computer Science 2022-06-20 Tsvetomila Mihaylova , Vlad Niculae , André F. T. Martins

Deep learning has been successfully applied to the segmentation of 3D Computed Tomography (CT) scans. Establishing the credibility of these segmentations requires uncertainty quantification (UQ) to identify untrustworthy predictions. Recent…

Image and Video Processing · Electrical Eng. & Systems 2020-04-03 Tyler LaBonte , Carianne Martinez , Scott A. Roberts

With the growth of data from new radio telescope facilities, machine-learning approaches to the morphological classification of radio galaxies are increasingly being utilised. However, while widely employed deep-learning models using…

Instrumentation and Methods for Astrophysics · Physics 2025-06-30 Natalie E. P. Lines , Joan Font-Quer Roset , Anna M. M. Scaife

Steerable models can provide very general and flexible equivariance by formulating equivariance requirements in the language of representation theory and feature fields, which has been recognized to be effective for many vision tasks.…

Computer Vision and Pattern Recognition · Computer Science 2022-08-09 Zhengyang Shen , Tao Hong , Qi She , Jinwen Ma , Zhouchen Lin

Equivariant Graph Neural Networks (eGNNs) trained on density-functional theory (DFT) data can potentially perform electronic structure prediction at unprecedented scales, enabling investigation of the electronic properties of materials with…

Machine Learning · Computer Science 2025-07-08 Manasa Kaniselvan , Alexander Maeder , Chen Hao Xia , Alexandros Nikolaos Ziogas , Mathieu Luisier

$\rm{SO}(3)$-equivariant networks are the dominant models for machine learning interatomic potentials (MLIPs). The key operation of such networks is the Clebsch-Gordan (CG) tensor product, which is computationally expensive. To accelerate…

Machine Learning · Computer Science 2026-01-14 Yuchao Lin , Cong Fu , Zachary Krueger , Haiyang Yu , Maho Nakata , Jianwen Xie , Emine Kucukbenli , Xiaofeng Qian , Shuiwang Ji

Deep Neural Networks (DNNs) are universal function approximators providing state-of- the-art solutions on wide range of applications. Common perceptual tasks such as speech recognition, image classification, and object tracking are now…

Machine Learning · Statistics 2017-11-08 Randall Balestriero , Richard Baraniuk

In this work we introduce a convolutional neural network (CNN) that jointly handles low-, mid-, and high-level vision tasks in a unified architecture that is trained end-to-end. Such a universal network can act like a `swiss knife' for…

Computer Vision and Pattern Recognition · Computer Science 2016-09-08 Iasonas Kokkinos

Integrating a notion of symmetry into point cloud neural networks is a provably effective way to improve their generalization capability. Of particular interest are $E(3)$ equivariant point cloud networks where Euclidean transformations…

Machine Learning · Computer Science 2024-02-14 Matan Atzmon , Jiahui Huang , Francis Williams , Or Litany

Deep generative models are increasingly used for molecular discovery, with most recent approaches relying on equivariant graph neural networks (GNNs) under the assumption that explicit equivariance is essential for generating high-quality…

Machine Learning · Computer Science 2025-07-15 Ewa M. Nowara , Joshua Rackers , Patricia Suriana , Pan Kessel , Max Shen , Andrew Martin Watkins , Michael Maser

In recent years, deep neural networks have been applied to obtain high performance of prediction, classification, and pattern recognition. However, the weights in these deep neural networks are difficult to be explained. Although a linear…

Machine Learning · Computer Science 2020-05-08 Chi-Hua Chen

Extending the translation equivariance property of convolutional neural networks to larger symmetry groups has been shown to reduce sample complexity and enable more discriminative feature learning. Further, exploiting additional symmetries…

Computer Vision and Pattern Recognition · Computer Science 2025-02-12 Lisa Weijler , Pedro Hermosilla

Deep neural networks have revolutionized many machine learning tasks in power systems, ranging from pattern recognition to signal processing. The data in these tasks is typically represented in Euclidean domains. Nevertheless, there is an…

Machine Learning · Computer Science 2021-06-15 Wenlong Liao , Birgitte Bak-Jensen , Jayakrishnan Radhakrishna Pillai , Yuelong Wang , Yusen Wang

Convolutional Neural Networks (CNNs) achieve impressive performance in a wide variety of fields. Their success benefited from a massive boost when very deep CNN models were able to be reliably trained. Despite their merits, CNNs fail to…

Computer Vision and Pattern Recognition · Computer Science 2019-08-20 Guohao Li , Matthias Müller , Ali Thabet , Bernard Ghanem