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Metanetworks are neural architectures designed to operate directly on pretrained weights to perform downstream tasks. However, the parameter space serves only as a proxy for the underlying function class, and the parameter-function mapping…

Machine Learning · Computer Science 2026-04-28 Viet-Hoang Tran , An Nguyen , Benoît Guérand , Thieu N. Vo , Tan M. Nguyen

Most existing expressivity theories for neural networks assume exact real arithmetic, whereas practical neural networks are executed under finite-precision floating-point arithmetic with implementation-dependent execution semantics. Recent…

Machine Learning · Computer Science 2026-05-28 Yeachan Park , Geonho Hwang , Wonyeol Lee , Sejun Park

Latent representations are used extensively for downstream tasks, such as visualization, interpolation or feature extraction of deep learning models. Invariant and equivariant neural networks are powerful and well-established models for…

Machine Learning · Computer Science 2025-01-16 Andreas Abildtrup Hansen , Anna Calissano , Aasa Feragen

Message passing neural networks have become a method of choice for learning on graphs, in particular the prediction of chemical properties and the acceleration of molecular dynamics studies. While they readily scale to large training data…

Machine Learning · Computer Science 2021-06-08 Kristof T. Schütt , Oliver T. Unke , Michael Gastegger

How can prior knowledge on the transformation invariances of a domain be incorporated into the architecture of a neural network? We propose Equivariant Transformers (ETs), a family of differentiable image-to-image mappings that improve the…

Computer Vision and Pattern Recognition · Computer Science 2019-05-28 Kai Sheng Tai , Peter Bailis , Gregory Valiant

We provide a theoretical explanation of the role of the number of nodes at each layer in deep neural networks. We prove that the largest variation of a deep neural network with ReLU activation function arises when the layer with the fewest…

Machine Learning · Statistics 2018-12-11 Yongdai Kim , Dongha Kim

In this paper, we introduce group convolutional neural networks (GCNNs) equivariant to color variation. GCNNs have been designed for a variety of geometric transformations from 2D and 3D rotation groups, to semi-groups such as scale.…

Computer Vision and Pattern Recognition · Computer Science 2026-04-14 Yulong Yang , Felix O'Mahony , Christine Allen-Blanchette

Most state-of-the-art neural network potentials do not account for molecular attributes other than atomic numbers and positions, which limits its range of applicability by design. In this work, we demonstrate the importance of including…

Machine Learning · Computer Science 2025-02-10 Guillem Simeon , Antonio Mirarchi , Raul P. Pelaez , Raimondas Galvelis , Gianni De Fabritiis

This article is concerned with the approximation and expressive powers of deep neural networks. This is an active research area currently producing many interesting papers. The results most commonly found in the literature prove that neural…

Machine Learning · Computer Science 2019-05-08 I. Daubechies , R. DeVore , S. Foucart , B. Hanin , G. Petrova

We consider functions from the real numbers to the real numbers, output by a neural network with 1 hidden activation layer, arbitrary width, and ReLU activation function. We assume that the parameters of the neural network are chosen…

Machine Learning · Computer Science 2023-04-20 David Holmes

Many learning tasks, including learning potential energy surfaces from ab initio calculations, involve global spatial symmetries and permutational symmetry between atoms or general particles. Equivariant graph neural networks are a standard…

Machine Learning · Computer Science 2024-05-24 Zimu Li , Zihan Pengmei , Han Zheng , Erik Thiede , Junyu Liu , Risi Kondor

Data arrives at our senses as a continuous stream, smoothly transforming from one instant to the next. These smooth transformations can be viewed as continuous symmetries of the environment that we inhabit, defining equivalence relations…

Machine Learning · Computer Science 2025-12-02 T. Anderson Keller

Deep neural networks lack straightforward ways to incorporate domain knowledge and are notoriously considered black boxes. Prior works attempted to inject domain knowledge into architectures implicitly through data augmentation. Building on…

Machine Learning · Computer Science 2022-11-18 Emmanouil Theodosis , Demba Ba

Group symmetry is inherent in a wide variety of data distributions. Data processing that preserves symmetry is described as an equivariant map and often effective in achieving high performance. Convolutional neural networks (CNNs) have been…

Machine Learning · Statistics 2020-12-29 Wataru Kumagai , Akiyoshi Sannai

Equivariances provide useful inductive biases in neural network modeling, with the translation equivariance of convolutional neural networks being a canonical example. Equivariances can be embedded in architectures through weight-sharing…

Machine Learning · Computer Science 2022-11-15 Tycho F. A. van der Ouderaa , David W. Romero , Mark van der Wilk

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

The principle of equivariance to symmetry transformations enables a theoretically grounded approach to neural network architecture design. Equivariant networks have shown excellent performance and data efficiency on vision and medical…

Machine Learning · Computer Science 2019-05-15 Taco S. Cohen , Maurice Weiler , Berkay Kicanaoglu , Max Welling

Convolutional neural networks are ubiquitous in Machine Learning applications for solving a variety of problems. They however can not be used in their native form when the domain of the data is commonly encountered manifolds such as the…

Computer Vision and Pattern Recognition · Computer Science 2018-08-08 Rudrasis Chakraborty , Monami Banerjee , Baba C. Vemuri

Symmetry is present in many tasks in computer vision, where the same class of objects can appear transformed, e.g. rotated due to different camera orientations, or scaled due to perspective. The knowledge of such symmetries in data coupled…

Image and Video Processing · Electrical Eng. & Systems 2022-07-25 Mateus Sangalli , Samy Blusseau , Santiago Velasco-Forero , Jesús Angulo

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…

Machine Learning · Computer Science 2016-06-06 Taco S. Cohen , Max Welling
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