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Related papers: Equivariance and generalization in neural networks

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Many quantities we are interested in predicting are geometric tensors; we refer to this class of problems as geometric prediction. Attempts to perform geometric prediction in real-world scenarios have been limited to approximating them…

Machine Learning · Computer Science 2020-06-26 Raphael J. L. Townshend , Brent Townshend , Stephan Eismann , Ron O. Dror

The effectiveness of neural processes (NPs) in modelling posterior prediction maps -- the mapping from data to posterior predictive distributions -- has significantly improved since their inception. This improvement can be attributed to two…

This paper presents a transformative framework for artificial neural networks over graded vector spaces, tailored to model hierarchical and structured data in fields like algebraic geometry and physics. By exploiting the algebraic…

Artificial Intelligence · Computer Science 2026-01-07 Tony Shaska

Neural networks that are equivariant to rotations, translations, reflections, and permutations on n-dimensional geometric space have shown promise in physical modeling for tasks such as accurately but inexpensively modeling complex…

Machine Learning · Computer Science 2023-01-25 Yuanqing Wang , John D. Chodera

Machine-learning models in chemistry - when based on descriptors of atoms embedded within molecules - face essential challenges in transferring the quality of predictions of local electronic structures and their associated properties across…

Chemical Physics · Physics 2024-09-27 Frederik Ø. Kjeldal , Janus J. Eriksen

One of the central challenges in modern machine learning is understanding how neural networks generalize knowledge learned from training data to unseen test data. While numerous empirical techniques have been proposed to improve…

Machine Learning · Computer Science 2025-04-18 Entao Yang , Xiaotian Zhang , Yue Shang , Ge Zhang

Equivariant neural networks have shown improved performance, expressiveness and sample complexity on symmetrical domains. But for some specific symmetries, representations, and choice of coordinates, the most common point-wise activations,…

Machine Learning · Computer Science 2024-01-18 Marco Pacini , Xiaowen Dong , Bruno Lepri , Gabriele Santin

We introduce a novel architecture for graph networks which is equivariant to any transformation in the coordinate embeddings that preserves the distance between neighbouring nodes. In particular, it is equivariant to the Euclidean and…

Machine Learning · Computer Science 2021-07-13 Francesco Farina , Emma Slade

Convolutional neural networks have shown remarkable performance in recent years on various computer vision problems. However, the traditional convolutional neural network architecture lacks a critical property: shift equivariance and…

Computer Vision and Pattern Recognition · Computer Science 2025-11-27 Quentin Gabot , Teck-Yian Lim , Jérémy Fix , Joana Frontera-Pons , Chengfang Ren , Jean-Philippe Ovarlez

Equivariant neural networks encode the intrinsic symmetry of data as an inductive bias, which has achieved impressive performance in wide domains. However, the understanding to their expressive power remains premature. Focusing on 2-layer…

Machine Learning · Computer Science 2026-05-18 Yuzhu Chen , Tian Qin , Xinmei Tian , Fengxiang He , Dacheng Tao

The ability to generalize compositionally is key to understanding the potentially infinite number of sentences that can be constructed in a human language from only a finite number of words. Investigating whether NLP models possess this…

Computation and Language · Computer Science 2022-09-23 Jennifer C. White , Ryan Cotterell

Convolutional neural networks revolutionized computer vision and natrual language processing. Their efficiency, as compared to fully connected neural networks, has its origin in the architecture, where convolutions reflect the translation…

Machine Learning · Computer Science 2023-01-10 Patrick Krüger , Hanno Gottschalk

In many real-world applications of regression, conditional probability estimation, and uncertainty quantification, exploiting symmetries rooted in physics or geometry can dramatically improve generalization and sample efficiency. While…

Machine Learning · Computer Science 2025-05-28 Daniel Ordoñez-Apraez , Vladimir Kostić , Alek Fröhlich , Vivien Brandt , Karim Lounici , Massimiliano Pontil

Many scientific problems require to process data in the form of geometric graphs. Unlike generic graph data, geometric graphs exhibit symmetries of translations, rotations, and/or reflections. Researchers have leveraged such inductive bias…

Machine Learning · Computer Science 2022-02-23 Jiaqi Han , Yu Rong , Tingyang Xu , Wenbing Huang

In certain situations, neural networks are trained upon data that obey underlying symmetries. However, the predictions do not respect the symmetries exactly unless embedded in the network structure. In this work, we introduce architectures…

Machine Learning · Computer Science 2022-04-28 Anwesh Bhattacharya , Marios Mattheakis , Pavlos Protopapas

Previous work on symmetric group equivariant neural networks generally only considered the case where the group acts by permuting the elements of a single vector. In this paper we derive formulae for general permutation equivariant layers,…

Machine Learning · Computer Science 2020-04-09 Erik Henning Thiede , Truong Son Hy , Risi Kondor

Equivariance is a powerful inductive bias in neural networks, improving generalisation and physical consistency. Recently, however, non-equivariant models have regained attention, due to their better runtime performance and imperfect…

Machine Learning · Computer Science 2026-05-27 Torben Berndt , Jan Stühmer

The set of functions parameterized by a linear fully-connected neural network is a determinantal variety. We investigate the subvariety of functions that are equivariant or invariant under the action of a permutation group. Examples of such…

Machine Learning · Computer Science 2025-01-13 Kathlén Kohn , Anna-Laura Sattelberger , Vahid Shahverdi

Many algorithms and observed phenomena in deep learning appear to be affected by parameter symmetries -- transformations of neural network parameters that do not change the underlying neural network function. These include linear mode…

Machine Learning · Computer Science 2024-10-16 Derek Lim , Theo Moe Putterman , Robin Walters , Haggai Maron , Stefanie Jegelka

That shared features between train and test data are required for generalisation in artificial neural networks has been a common assumption of both proponents and critics of these models. Here, we show that convolutional architectures avoid…

Neural and Evolutionary Computing · Computer Science 2021-07-15 Jeff Mitchell , Jeffrey S. Bowers
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