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We introduce Group equivariant Convolutional Neural Networks (G-CNNs), a natural generalization of convolutional neural networks that reduces sample complexity by exploiting symmetries. G-CNNs use G-convolutions, a new type of layer that…

机器学习 · 计算机科学 2016-06-06 Taco S. Cohen , Max Welling

Recent works show that group equivariance as an inductive bias improves neural network performance for both classification and generation. However, designing group-equivariant neural networks is challenging when the group of interest is…

机器学习 · 计算机科学 2021-06-09 Sourya Basu , Akshayaa Magesh , Harshit Yadav , Lav R. Varshney

Equivariant neural networks, whose hidden features transform according to representations of a group G acting on the data, exhibit training efficiency and an improved generalisation performance. In this work, we extend group invariant and…

机器学习 · 计算机科学 2024-04-15 Robin Winter , Marco Bertolini , Tuan Le , Frank Noé , Djork-Arné Clevert

Symmetries and equivariance are fundamental to the generalization of neural networks on domains such as images, graphs, and point clouds. Existing work has primarily focused on a small number of groups, such as the translation, rotation,…

机器学习 · 计算机科学 2021-04-20 Marc Finzi , Max Welling , Andrew Gordon Wilson

Group equivariant convolutional neural networks (G-CNNs) are generalizations of convolutional neural networks (CNNs) which excel in a wide range of technical applications by explicitly encoding symmetries, such as rotations and…

机器学习 · 计算机科学 2022-09-14 Hannah Lawrence , Kristian Georgiev , Andrew Dienes , Bobak T. Kiani

In recent years, deep learning techniques have shown great success in various tasks related to inverse problems, where a target quantity of interest can only be observed through indirect measurements by a forward operator. Common approaches…

数值分析 · 数学 2024-03-18 Matthias Beckmann , Nick Heilenkötter

The inclusion of symmetries as an inductive bias, known as equivariance, often improves generalization on geometric data (e.g. grids, sets, and graphs). However, equivariant architectures are usually highly constrained, designed for…

机器学习 · 计算机科学 2026-03-23 Abhinav Goel , Derek Lim , Hannah Lawrence , Stefanie Jegelka , Ningyuan Huang

Constructing model-agnostic group equivariant networks, such as equitune (Basu et al., 2023b) and its generalizations (Kim et al., 2023), can be computationally expensive for large product groups. We address this problem by providing…

机器学习 · 计算机科学 2024-10-08 Razan Baltaji , Sourya Basu , Lav R. Varshney

Steerable convolutional neural networks (CNNs) provide a general framework for building neural networks equivariant to translations and transformations of an origin-preserving group $G$, such as reflections and rotations. They rely on…

机器学习 · 计算机科学 2023-10-30 Maksim Zhdanov , Nico Hoffmann , Gabriele Cesa

Group equivariant neural networks are growing in importance owing to their ability to generalise well in applications where the data has known underlying symmetries. Recent characterisations of a class of these networks that use high-order…

机器学习 · 计算机科学 2024-12-17 Edward Pearce-Crump , William J. Knottenbelt

Reductive Lie Groups, such as the orthogonal groups, the Lorentz group, or the unitary groups, play essential roles across scientific fields as diverse as high energy physics, quantum mechanics, quantum chromodynamics, molecular dynamics,…

机器学习 · 统计学 2023-06-02 Ilyes Batatia , Mario Geiger , Jose Munoz , Tess Smidt , Lior Silberman , Christoph Ortner

This paper introduces a new model to learn graph neural networks equivariant to rotations, translations, reflections and permutations called E(n)-Equivariant Graph Neural Networks (EGNNs). In contrast with existing methods, our work does…

机器学习 · 计算机科学 2022-02-17 Victor Garcia Satorras , Emiel Hoogeboom , Max Welling

Group equivariant neural networks have been explored in the past few years and are interesting from theoretical and practical standpoints. They leverage concepts from group representation theory, non-commutative harmonic analysis and…

机器学习 · 计算机科学 2020-05-01 Carlos Esteves

Quantum neural network architectures that have little-to-no inductive biases are known to face trainability and generalization issues. Inspired by a similar problem, recent breakthroughs in machine learning address this challenge by…

Equivariance of linear neural network layers is well studied. In this work, we relax the equivariance condition to only be true in a projective sense. We propose a way to construct a projectively equivariant neural network through building…

计算机视觉与模式识别 · 计算机科学 2023-12-21 Georg Bökman , Axel Flinth , Fredrik Kahl

The difficult problem of relating the static structure of glassy liquids and their dynamics is a good target for Machine Learning, an approach which excels at finding complex patterns hidden in data. Indeed, this approach is currently a hot…

软凝聚态物质 · 物理学 2024-05-29 Francesco Saverio Pezzicoli , Guillaume Charpiat , François P. Landes

Learning to reason about relations and dynamics over multiple interacting objects is a challenging topic in machine learning. The challenges mainly stem from that the interacting systems are exponentially-compositional, symmetrical, and…

机器学习 · 计算机科学 2022-03-15 Wenbing Huang , Jiaqi Han , Yu Rong , Tingyang Xu , Fuchun Sun , Junzhou Huang

The development of efficient machine learning models for molecular systems representation is becoming crucial in scientific research. We introduce TensorNet, an innovative O(3)-equivariant message-passing neural network architecture that…

机器学习 · 计算机科学 2023-10-31 Guillem Simeon , Gianni de Fabritiis

Geometric deep learning enables the encoding of physical symmetries in modeling 3D objects. Despite rapid progress in encoding 3D symmetries into Graph Neural Networks (GNNs), a comprehensive evaluation of the expressiveness of these…

机器学习 · 计算机科学 2023-04-12 Weitao Du , Yuanqi Du , Limei Wang , Dieqiao Feng , Guifeng Wang , Shuiwang Ji , Carla Gomes , Zhi-Ming Ma

Many problems in computer vision and machine learning can be cast as learning on hypergraphs that represent higher-order relations. Recent approaches for hypergraph learning extend graph neural networks based on message passing, which is…

机器学习 · 计算机科学 2022-08-23 Jinwoo Kim , Saeyoon Oh , Sungjun Cho , Seunghoon Hong
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