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Related papers: E(n) Equivariant Normalizing Flows

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This paper introduces equivariant hamiltonian flows, a method for learning expressive densities that are invariant with respect to a known Lie-algebra of local symmetry transformations while providing an equivariant representation of the…

Machine Learning · Statistics 2019-10-01 Danilo Jimenez Rezende , Sébastien Racanière , Irina Higgins , Peter Toth

Graph Neural Networks (GNN) come in many flavors, but should always be either invariant (permutation of the nodes of the input graph does not affect the output) or equivariant (permutation of the input permutes the output). In this paper,…

Machine Learning · Computer Science 2019-10-25 Nicolas Keriven , Gabriel Peyré

We propose a continuous normalizing flow for sampling from the high-dimensional probability distributions of Quantum Field Theories in Physics. In contrast to the deep architectures used so far for this task, our proposal is based on a…

Machine Learning · Computer Science 2021-11-29 Pim de Haan , Corrado Rainone , Miranda C. N. Cheng , Roberto Bondesan

Equivariant Graph Neural Networks (GNNs) have significantly advanced the modeling of 3D molecular structure by leveraging group representations. However, their message passing, heavily relying on Clebsch-Gordan tensor product convolutions,…

Machine Learning · Computer Science 2025-09-30 Junyi An , Xinyu Lu , Chao Qu , Yunfei Shi , Peijia Lin , Qianwei Tang , Licheng Xu , Fenglei Cao , Yuan Qi

We apply a unified machine-learning framework based on Normalizing Flows (NFs) for the event-by-event reconstruction of invisible momenta and the subsequent evaluation of spin-sensitive observables in top-quark pair and dark-matter (DM)…

High Energy Physics - Phenomenology · Physics 2025-10-14 E. Abasov , L. Dudko , E. Iudin , A. Markina , P. Volkov , G. Vorotnikov , M. Perfilov , A. Zaborenko

Equivariant Graph Neural Networks (GNNs) have demonstrated significant success across various applications. To achieve completeness -- that is, the universal approximation property over the space of equivariant functions -- the network must…

Machine Learning · Computer Science 2025-10-16 Jiacheng Cen , Anyi Li , Ning Lin , Tingyang Xu , Yu Rong , Deli Zhao , Zihe Wang , Wenbing Huang

Bayesian Flow Networks (BFNs) has been recently proposed as one of the most promising direction to universal generative modelling, having ability to learn any of the data type. Their power comes from the expressiveness of neural networks…

Machine Learning · Computer Science 2023-10-19 Mateusz Pyla , Kamil Deja , Bartłomiej Twardowski , Tomasz Trzciński

We present a novel generative modeling method called diffusion normalizing flow based on stochastic differential equations (SDEs). The algorithm consists of two neural SDEs: a forward SDE that gradually adds noise to the data to transform…

Machine Learning · Computer Science 2021-10-15 Qinsheng Zhang , Yongxin Chen

Convolutional Neural Networks (CNN) have been successful in processing data signals that are uniformly sampled in the spatial domain (e.g., images). However, most data signals do not natively exist on a grid, and in the process of being…

Computer Vision and Pattern Recognition · Computer Science 2019-01-09 Chiyu "Max" Jiang , Dequan Wang , Jingwei Huang , Philip Marcus , Matthias Nießner

Normalizing flows provide a general mechanism for defining expressive probability distributions, only requiring the specification of a (usually simple) base distribution and a series of bijective transformations. There has been much recent…

Applications of machine learning techniques for materials modeling typically involve functions known to be equivariant or invariant to specific symmetries. While graph neural networks (GNNs) have proven successful in such tasks, they…

Normalizing flows (NFs) have become a prominent method for deep generative models that allow for an analytic probability density estimation and efficient synthesis. However, a flow-based network is considered to be inefficient in parameter…

Machine Learning · Computer Science 2020-10-26 Sang-gil Lee , Sungwon Kim , Sungroh Yoon

Causal inconsistency arises when the underlying causal graphs captured by generative models like \textit{Normalizing Flows} (NFs) are inconsistent with those specified in causal models like \textit{Struct Causal Models} (SCMs). This…

Machine Learning · Computer Science 2024-12-18 Qingyang Zhou , Kangjie Lu , Meng Xu

3D Euclidean symmetry equivariant neural networks have demonstrated notable success in modeling complex physical systems. We introduce a framework for relaxed $E(3)$ graph equivariant neural networks that can learn and represent symmetry…

Machine Learning · Computer Science 2024-12-11 Elyssa Hofgard , Rui Wang , Robin Walters , Tess Smidt

Currently there exists rather promising new trend in machine leaning (ML) based on the relationship between neural networks (NN) and Gaussian processes (GP), including many related subtopics, e.g., signal propagation in NNs, theoretical…

Machine Learning · Computer Science 2023-03-01 Andrey Demichev , Alexander Kryukov

Convolutional Neural Networks(CNNs) has achieved remarkable performance breakthrough in Euclidean structure data. Recently, aggregation-transformation based Graph Neural networks(GNNs) gradually produce a powerful performance on…

Machine Learning · Computer Science 2021-02-05 Jingzhao Hu , Xiaoqi Zhang , Qiaomei Jia , Chen Wang , Qirong Bu , Jun Feng

Graph neural networks (GNNs) have demonstrated success in modeling relational data, especially for data that exhibits homophily: when a connection between nodes tends to imply that they belong to the same class. However, while this…

Machine Learning · Computer Science 2023-06-23 Andreea Deac , Jian Tang

Exploiting symmetries and invariance in data is a powerful, yet not fully exploited, way to achieve better generalisation with more efficiency. In this paper, we introduce two graph network architectures that are equivariant to several…

Machine Learning · Computer Science 2021-06-01 Francesco Farina , Emma Slade

Real-world data with underlying structure, such as pictures of faces, are hypothesized to lie on a low-dimensional manifold. This manifold hypothesis has motivated state-of-the-art generative algorithms that learn low-dimensional data…

Machine Learning · Statistics 2022-04-28 Edmond Cunningham , Renos Zabounidis , Abhinav Agrawal , Madalina Fiterau , Daniel Sheldon

Coupling normalizing flows allow for fast sampling and density evaluation, making them the tool of choice for probabilistic modeling of physical systems. However, the standard coupling architecture precludes endowing flows that operate on…

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