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We provide a full characterisation of all of the possible alternating group ($A_n$) equivariant neural networks whose layers are some tensor power of $\mathbb{R}^{n}$. In particular, we find a basis of matrices for the learnable, linear,…

Machine Learning · Computer Science 2023-06-21 Edward Pearce-Crump

Little is known about the training dynamics of equivariant neural networks, in particular how it compares to data augmented training of their non-equivariant counterparts. Recently, neural tangent kernels (NTKs) have emerged as a powerful…

Machine Learning · Computer Science 2025-02-03 Philipp Misof , Pan Kessel , Jan E. Gerken

Machine learning has recently entered into the mainstream of coarse-grained (CG) molecular modeling and simulation. While a variety of methods for incorporating deep learning into these models exist, many of them involve training neural…

Chemical Physics · Physics 2023-11-02 Timothy D. Loose , Patrick G. Sahrmann , Thomas S. Qu , Gregory A. Voth

We propose a new generalization of neural network parameter spaces with noncommutative $C^*$-algebra, which possesses a rich noncommutative structure of products. We show that this noncommutative structure induces powerful effects in…

Operator Algebras · Mathematics 2024-07-09 Ryuichiro Hataya , Yuka Hashimoto

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…

Machine Learning · Computer Science 2022-02-17 Victor Garcia Satorras , Emiel Hoogeboom , Max Welling

The translation equivariance of convolutions can make convolutional neural networks translation equivariant or invariant. Equivariance to other transformations (e.g. rotations, affine transformations, scalings) may also be desirable as soon…

Signal Processing · Electrical Eng. & Systems 2021-05-05 Mateus Sangalli , Samy Blusseau , Santiago Velasco-Forero , Jesus Angulo

Group Convolutional Neural Networks (G-CNNs) constrain learned features to respect the symmetries in the selected group, and lead to better generalization when these symmetries appear in the data. If this is not the case, however,…

Computer Vision and Pattern Recognition · Computer Science 2023-01-18 David W. Romero , Suhas Lohit

Group equivariance (e.g. SE(3) equivariance) is a critical physical symmetry in science, from classical and quantum physics to computational biology. It enables robust and accurate prediction under arbitrary reference transformations. In…

Computational Engineering, Finance, and Science · Computer Science 2023-02-08 Weitao Du , He Zhang , Yuanqi Du , Qi Meng , Wei Chen , Bin Shao , Tie-Yan Liu

The algebraic formulation of the quantum group covariant noncommutative geometry in the framework of the $R$-matrix approach to the theory of quantum groups is given. We consider structure groups taking values in the quantum groups and…

High Energy Physics - Theory · Physics 2011-04-15 A. P. Isaev

Recent work has constructed neural networks that are equivariant to continuous symmetry groups such as 2D and 3D rotations. This is accomplished using explicit Lie group representations to derive the equivariant kernels and nonlinearities.…

Machine Learning · Computer Science 2022-12-08 Noah Shutty , Casimir Wierzynski

A challenging problem in many modern machine learning tasks is to process weight-space features, i.e., to transform or extract information from the weights and gradients of a neural network. Recent works have developed promising…

Machine Learning · Computer Science 2024-02-09 Allan Zhou , Chelsea Finn , James Harrison

We introduce a method to design a computationally efficient $G$-invariant neural network that approximates functions invariant to the action of a given permutation subgroup $G \leq S_n$ of the symmetric group on input data. The key element…

Machine Learning · Computer Science 2021-10-15 Piotr Kicki , Mete Ozay , Piotr Skrzypczyński

In recent years the use of convolutional layers to encode an inductive bias (translational equivariance) in neural networks has proven to be a very fruitful idea. The successes of this approach have motivated a line of research into…

We study the problem of learning equivariant neural networks via gradient descent. The incorporation of known symmetries ("equivariance") into neural nets has empirically improved the performance of learning pipelines, in domains ranging…

Machine Learning · Computer Science 2024-01-04 Bobak T. Kiani , Thien Le , Hannah Lawrence , Stefanie Jegelka , Melanie Weber

Equivariant quantum neural networks (QNNs) are promising variational models that exploit symmetries to improve machine learning capabilities. Despite theoretical developments in equivariant QNNs, their implementation on near-term quantum…

Quantum Physics · Physics 2026-04-20 Koki Chinzei , Quoc Hoan Tran , Yasuhiro Endo , Hirotaka Oshima

Clifford Group Equivariant Neural Networks (CGENNs) leverage Clifford algebras and multivectors as an alternative approach to incorporating group equivariance to ensure symmetry constraints in neural representations. In principle, this…

Machine Learning · Computer Science 2025-06-11 Riccardo Ali , Paulina Kulytė , Haitz Sáez de Ocáriz Borde , Pietro Liò

Group equivariant convolutional networks (GCNNs) endow classical convolutional networks with additional symmetry priors, which can lead to a considerably improved performance. Recent advances in the theoretical description of GCNNs revealed…

Machine Learning · Computer Science 2021-01-22 Leon Lang , Maurice Weiler

We develop a theory of category-equivariant neural networks (CENNs) that unifies group/groupoid-equivariant networks, poset/lattice-equivariant networks, graph and sheaf neural networks. Equivariance is formulated as naturality in a…

Machine Learning · Computer Science 2025-12-24 Yoshihiro Maruyama

We prove the existence of a quantum isometry groups for new classes of metric spaces: (i) geodesic metrics for compact connected Riemannian manifolds (possibly with boundary) and (ii) metric spaces admitting a uniformly distributed…

Quantum Algebra · Mathematics 2020-10-28 Alexandru Chirvasitu , Debashish Goswami

Incorporating permutation equivariance into neural networks has proven to be useful in ensuring that models respect symmetries that exist in data. Symmetric tensors, which naturally appear in statistics, machine learning, and graph theory,…

Machine Learning · Computer Science 2025-05-26 Edward Pearce-Crump