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A quantum generalization of Natural Gradient Descent is presented as part of a general-purpose optimization framework for variational quantum circuits. The optimization dynamics is interpreted as moving in the steepest descent direction…

Quantum Physics · Physics 2020-05-27 James Stokes , Josh Izaac , Nathan Killoran , Giuseppe Carleo

The decentralized gradient descent (DGD) algorithm, and its sibling, diffusion, are workhorses in decentralized machine learning, distributed inference and estimation, and multi-agent coordination. We propose a novel, principled framework…

Signal Processing · Electrical Eng. & Systems 2025-06-04 Erik G. Larsson , Nicolo Michelusi

Despite recent theoretical progress on the non-convex optimization of two-layer neural networks, it is still an open question whether gradient descent on neural networks without unnatural modifications can achieve better sample complexity…

Machine Learning · Computer Science 2023-10-10 Arvind Mahankali , Jeff Z. Haochen , Kefan Dong , Margalit Glasgow , Tengyu Ma

This work bridges two important concepts: the Neural Tangent Kernel (NTK), which captures the evolution of deep neural networks (DNNs) during training, and the Neural Collapse (NC) phenomenon, which refers to the emergence of symmetry and…

Machine Learning · Computer Science 2023-11-07 Mariia Seleznova , Dana Weitzner , Raja Giryes , Gitta Kutyniok , Hung-Hsu Chou

Graph kernels are widely used for measuring the similarity between graphs. Many existing graph kernels, which focus on local patterns within graphs rather than their global properties, suffer from significant structure information loss when…

Machine Learning · Computer Science 2019-12-02 Lingfei Wu , Ian En-Hsu Yen , Zhen Zhang , Kun Xu , Liang Zhao , Xi Peng , Yinglong Xia , Charu Aggarwal

Recent works have partly attributed the generalization ability of over-parameterized neural networks to frequency bias -- networks trained with gradient descent on data drawn from a uniform distribution find a low frequency fit before high…

Machine Learning · Computer Science 2020-03-11 Ronen Basri , Meirav Galun , Amnon Geifman , David Jacobs , Yoni Kasten , Shira Kritchman

This paper introduces the Neural Differential Manifold (NDM), a novel neural network architecture that explicitly incorporates geometric structure into its fundamental design. Departing from conventional Euclidean parameter spaces, the NDM…

Machine Learning · Computer Science 2025-10-30 Di Zhang

Natural-gradient descent (NGD) on structured parameter spaces (e.g., low-rank covariances) is computationally challenging due to difficult Fisher-matrix computations. We address this issue by using \emph{local-parameter coordinates} to…

Machine Learning · Statistics 2022-01-19 Wu Lin , Frank Nielsen , Mohammad Emtiyaz Khan , Mark Schmidt

In this paper, we develop an approach to exploiting kernel methods with manifold-valued data. In many computer vision problems, the data can be naturally represented as points on a Riemannian manifold. Due to the non-Euclidean geometry of…

Computer Vision and Pattern Recognition · Computer Science 2015-03-18 Sadeep Jayasumana , Richard Hartley , Mathieu Salzmann , Hongdong Li , Mehrtash Harandi

The fundamental principle of Graph Neural Networks (GNNs) is to exploit the structural information of the data by aggregating the neighboring nodes using a `graph convolution' in conjunction with a suitable choice for the network…

Machine Learning · Computer Science 2023-11-01 Mahalakshmi Sabanayagam , Pascal Esser , Debarghya Ghoshdastidar

Gradients of neural networks encode valuable information for optimization, editing, and analysis of models. Therefore, practitioners often treat gradients as inputs to task-specific algorithms, e.g. for pruning or optimization. Recent works…

Machine Learning · Computer Science 2025-10-14 Yoav Gelberg , Yam Eitan , Aviv Navon , Aviv Shamsian , Theo , Putterman , Michael Bronstein , Haggai Maron

Graph neural networks (GNNs) have achieved superior performance on node classification tasks in the last few years. Commonly, this is framed in a transductive semi-supervised learning setup wherein the entire graph, including the target…

Machine Learning · Computer Science 2021-10-11 Artun Bayer , Arindam Chowdhury , Santiago Segarra

Graph kernels used to be the dominant approach to feature engineering for structured data, which are superseded by modern GNNs as the former lacks learnability. Recently, a suite of Kernel Convolution Networks (KCNs) successfully…

Machine Learning · Computer Science 2024-02-12 Meng-Chieh Lee , Lingxiao Zhao , Leman Akoglu

Many supervised learning tasks have intrinsic symmetries, such as translational and rotational symmetry in image classifications. These symmetries can be exploited to enhance performance. We formulate the symmetry constraints into a concise…

Quantum Physics · Physics 2024-08-14 Kaiming Bian , Shitao Zhang , Fei Meng , Wen Zhang , Oscar Dahlsten

The generalization properties of Gaussian processes depend heavily on the choice of kernel, and this choice remains a dark art. We present the Neural Kernel Network (NKN), a flexible family of kernels represented by a neural network. The…

Machine Learning · Computer Science 2018-08-07 Shengyang Sun , Guodong Zhang , Chaoqi Wang , Wenyuan Zeng , Jiaman Li , Roger Grosse

The behavior of the gradient descent (GD) algorithm is analyzed for a deep neural network model with skip-connections. It is proved that in the over-parametrized regime, for a suitable initialization, with high probability GD can find a…

Machine Learning · Computer Science 2019-04-16 Weinan E , Chao Ma , Qingcan Wang , Lei Wu

We propose efficient numerical schemes for implementing the natural gradient descent (NGD) for a broad range of metric spaces with applications to PDE-based optimization problems. Our technique represents the natural gradient direction as a…

Optimization and Control · Mathematics 2023-01-12 Levon Nurbekyan , Wanzhou Lei , Yunan Yang

Graph neural networks (GNNs) have demonstrated great success in representation learning for graph-structured data. The layer-wise graph convolution in GNNs is shown to be powerful at capturing graph topology. During this process, GNNs are…

Machine Learning · Computer Science 2021-12-10 Mingxuan Ju , Shifu Hou , Yujie Fan , Jianan Zhao , Liang Zhao , Yanfang Ye

Recently, several studies have proven the global convergence and generalization abilities of the gradient descent method for two-layer ReLU networks. Most studies especially focused on the regression problems with the squared loss function,…

Machine Learning · Statistics 2020-03-19 Atsushi Nitanda , Geoffrey Chinot , Taiji Suzuki

A longstanding goal in the theory of deep learning is to characterize the conditions under which a given neural network architecture will be trainable, and if so, how well it might generalize to unseen data. In this work, we provide such a…

Machine Learning · Computer Science 2020-07-14 Lechao Xiao , Jeffrey Pennington , Samuel S. Schoenholz