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Graph neural networks (GNNs) have become increasingly popular for classification tasks on graph-structured data. Yet, the interplay between graph topology and feature evolution in GNNs is not well understood. In this paper, we focus on…

Machine Learning · Computer Science 2023-10-27 Vignesh Kothapalli , Tom Tirer , Joan Bruna

Deep neural networks give us a powerful method to model the training dataset's relationship between input and output. We can regard that as a complex adaptive system consisting of many artificial neurons that work as an adaptive memory as a…

Disordered Systems and Neural Networks · Physics 2024-05-08 Kenichi Nakazato

Graph Neural Networks (GNNs) have shown promising results in modeling graphs in various tasks. The training of GNNs, especially on specialized tasks such as bioinformatics, demands extensive expert annotations, which are expensive and…

Machine Learning · Computer Science 2025-05-27 Minhua Lin , Enyan Dai , Junjie Xu , Jinyuan Jia , Xiang Zhang , Suhang Wang

Grokking -- the delayed transition from memorization to generalization in small algorithmic tasks -- remains poorly understood. We present a geometric analysis of optimization dynamics in transformers trained on modular arithmetic. PCA of…

Machine Learning · Computer Science 2026-04-06 Yongzhong Xu

Graph neural networks (GNNs) have achieved strong performance in various applications. In the real world, network data is usually formed in a streaming fashion. The distributions of patterns that refer to neighborhood information of nodes…

Machine Learning · Computer Science 2020-12-07 Junshan Wang , Guojie Song , Yi Wu , Liang Wang

Modern neural networks are often regarded as complex black-box functions whose behavior is difficult to understand owing to their nonlinear dependence on the data and the nonconvexity in their loss landscapes. In this work, we show that…

Machine Learning · Computer Science 2020-06-26 Wei Hu , Lechao Xiao , Ben Adlam , Jeffrey Pennington

Grokking the delayed transition from memorization to generalization in neural networks remains poorly understood, in part because prior empirical studies confound the roles of architecture, optimization, and regularization. We present a…

Machine Learning · Computer Science 2026-03-27 Shalima Binta Manir , Anamika Paul Rupa

This paper demonstrates that grokking behavior in modular arithmetic with a modulus P in a neural network can be controlled by modifying the profile of the activation function as well as the depth and width of the model. Plotting the even…

Machine Learning · Computer Science 2024-11-11 Ahmed Salah , David Yevick

Graph Neural Networks (GNN) are currently the most popular approach for learning and prediction on graph-structured data and are deployed in various fields, from social network analysis to drug discovery. However, there is limited…

Methodology · Statistics 2026-05-26 Nil Ayday , Mahalakshmi Sabanayagam , Debarghya Ghoshdastidar

We study the relationship between the frequency of a function and the speed at which a neural network learns it. We build on recent results that show that the dynamics of overparameterized neural networks trained with gradient descent can…

Machine Learning · Computer Science 2019-12-03 Ronen Basri , David Jacobs , Yoni Kasten , Shira Kritchman

Despite the extreme popularity of deep learning in science and industry, its formal understanding is limited. This thesis puts forth notions of rank as key for developing a theory of deep learning, focusing on the fundamental aspects of…

Machine Learning · Computer Science 2024-12-31 Noam Razin

Grokking - the delayed transition from memorisation to generalisation in neural networks - remains poorly understood. We study this phenomenon through the geometry of learned representations and identify a consistent empirical signature…

Machine Learning · Computer Science 2026-05-13 Truong Xuan Khanh , Truong Quynh Hoa , Luu Duc Trung , Phan Thanh Duc

Graph Convolutional Networks (GCNs) have emerged as powerful tools for learning on network structured data. Although empirically successful, GCNs exhibit certain behaviour that has no rigorous explanation -- for instance, the performance of…

Machine Learning · Computer Science 2023-11-07 Mahalakshmi Sabanayagam , Pascal Esser , Debarghya Ghoshdastidar

In physics, complex systems are often simplified into minimal, solvable models that retain only the core principles. In machine learning, layerwise linear models (e.g., linear neural networks) act as simplified representations of neural…

At initialization, artificial neural networks (ANNs) are equivalent to Gaussian processes in the infinite-width limit, thus connecting them to kernel methods. We prove that the evolution of an ANN during training can also be described by a…

Machine Learning · Computer Science 2020-02-11 Arthur Jacot , Franck Gabriel , Clément Hongler

Recurrent Neural Networks (RNNs) frequently exhibit complicated dynamics, and their sensitivity to the initialization process often renders them notoriously hard to train. Recent works have shed light on such phenomena analyzing when…

Machine Learning · Computer Science 2022-10-12 Vaggos Chatziafratis , Ioannis Panageas , Clayton Sanford , Stelios Andrew Stavroulakis

Why heavily parameterized neural networks (NNs) do not overfit the data is an important long standing open question. We propose a phenomenological model of the NN training to explain this non-overfitting puzzle. Our linear frequency…

Machine Learning · Computer Science 2021-05-26 Yaoyu Zhang , Tao Luo , Zheng Ma , Zhi-Qin John Xu

Firing rate fluctuations in neural populations are observed experimentally over multiple time scales, in single neurons, across trials when elicited by stimuli, and across populations. In this work, we examine how firing rate fluctuations…

Neurons and Cognition · Quantitative Biology 2026-05-15 Wilten Nicola , Sue Ann Campbell

An important characteristic of neural networks is their ability to learn representations of the input data with effective features for prediction, which is believed to be a key factor to their superior empirical performance. To better…

Machine Learning · Computer Science 2022-06-06 Zhenmei Shi , Junyi Wei , Yingyu Liang

Increase in data, size, or compute can lead to sudden learning of specific capabilities by a neural network -- a phenomenon often called "emergence''. Beyond scientific understanding, establishing the causal factors underlying such emergent…

Machine Learning · Computer Science 2024-09-10 Ekdeep Singh Lubana , Kyogo Kawaguchi , Robert P. Dick , Hidenori Tanaka