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Gradually growing the depth of Transformers during training can not only reduce training cost but also lead to improved reasoning performance, as shown by MIDAS (Saunshi et al., 2024). Thus far, however, a mechanistic understanding of these…

Computation and Language · Computer Science 2025-12-10 Ferdinand Kapl , Emmanouil Angelis , Tobias Höppe , Kaitlin Maile , Johannes von Oswald , Nino Scherrer , Stefan Bauer

Graph Transformers (GTs) have demonstrated a strong capability in modeling graph structures by addressing the intrinsic limitations of graph neural networks (GNNs), such as over-smoothing and over-squashing. Recent studies have proposed…

Machine Learning · Computer Science 2025-02-28 Chaohao Yuan , Kangfei Zhao , Ercan Engin Kuruoglu , Liang Wang , Tingyang Xu , Wenbing Huang , Deli Zhao , Hong Cheng , Yu Rong

Given a target function $f$, how large must a neural network be in order to approximate $f$? Recent works examine this basic question on neural network \textit{expressivity} from the lens of dynamical systems and provide novel…

Machine Learning · Computer Science 2021-10-22 Clayton Sanford , Vaggos Chatziafratis

Large language models exhibit surprising emergent generalization properties, yet also struggle on many simple reasoning tasks such as arithmetic and parity. This raises the question of if and when Transformer models can learn the true…

Machine Learning · Computer Science 2023-10-25 Hattie Zhou , Arwen Bradley , Etai Littwin , Noam Razin , Omid Saremi , Josh Susskind , Samy Bengio , Preetum Nakkiran

In this contribution, we demonstrate that Graph Neural Networks and Transformers can learn to reason about geometric constraints. We train them to predict spatial position of points in a discrete 2D grid from a set of constraints that…

Machine Learning · Computer Science 2026-03-03 Jan Hůla , David Mojžíšek , Jiří Janeček , David Herel , Mikoláš Janota

Despite their central role in the success of foundational models and large-scale language modeling, the theoretical foundations governing the operation of Transformers remain only partially understood. Contemporary research has largely…

Machine Learning · Computer Science 2025-06-02 Sagar Ghosh , Kushal Bose , Swagatam Das

Transformers, especially the decoder-only variants, are the backbone of most modern large language models; yet we do not have much understanding of their expressive power except for the simple $1$-layer case. Due to the difficulty of…

Machine Learning · Computer Science 2024-12-05 Lijie Chen , Binghui Peng , Hongxun Wu

We investigate how embedding dimension affects the emergence of an internal "world model" in a transformer trained with reinforcement learning to perform bubble-sort-style adjacent swaps. Models achieve high accuracy even with very small…

Machine Learning · Computer Science 2025-10-22 Brady Bhalla , Honglu Fan , Nancy Chen , Tony Yue YU

A long-standing goal in deep learning has been to characterize the learning behavior of black-box models in a more interpretable manner. For graph neural networks (GNNs), considerable advances have been made in formalizing what functions…

Machine Learning · Computer Science 2024-06-19 Chenxiao Yang , Qitian Wu , David Wipf , Ruoyu Sun , Junchi Yan

We consider the problem of estimating the graph size, where one is given only local access to the graph. We formally define a query model in which one starts with a \emph{seed} node and is allowed to make queries about neighbours of nodes…

Data Structures and Algorithms · Computer Science 2017-02-15 Varun Kanade , Frederik Mallmann-Trenn , Victor Verdugo

In this paper we present an algorithmic framework for solving a class of combinatorial optimization problems on graphs with bounded pathwidth. The problems are NP-hard in general, but solvable in linear time on this type of graphs. The…

Data Structures and Algorithms · Computer Science 2012-12-18 Mugurel Ionut Andreica

Graphs naturally appear in several real-world contexts including social networks, the web network, and telecommunication networks. While the analysis and the understanding of graph structures have been a central area of study in algorithm…

Data Structures and Algorithms · Computer Science 2019-09-17 Gramoz Goranci

Deep neural networks for graphs have emerged as a powerful tool for learning on complex non-euclidean data, which is becoming increasingly common for a variety of different applications. Yet, although their potential has been widely…

Robotics · Computer Science 2023-10-09 Francesca Pistilli , Giuseppe Averta

Graph embedding aims at learning a vector-based representation of vertices that incorporates the structure of the graph. This representation then enables inference of graph properties. Existing graph embedding techniques, however, do not…

In the last decade or so, we have witnessed deep learning reinvigorating the machine learning field. It has solved many problems in the domains of computer vision, speech recognition, natural language processing, and various other tasks…

Machine Learning · Computer Science 2021-09-09 Lilapati Waikhom , Ripon Patgiri

State-of-the-art Graph Neural Networks (GNNs) have limited scalability with respect to the graph and model sizes. On large graphs, increasing the model depth often means exponential expansion of the scope (i.e., receptive field). Beyond…

Graph Transformers, which incorporate self-attention and positional encoding, have recently emerged as a powerful architecture for various graph learning tasks. Despite their impressive performance, the complex non-convex interactions…

Machine Learning · Computer Science 2024-06-05 Hongkang Li , Meng Wang , Tengfei Ma , Sijia Liu , Zaixi Zhang , Pin-Yu Chen

Transformer-based models have recently become wildly successful across a diverse set of domains. At the same time, recent work has shown empirically and theoretically that Transformers are inherently limited. Specifically, they argue that…

Machine Learning · Computer Science 2024-07-30 Gbètondji J-S Dovonon , Michael M. Bronstein , Matt J. Kusner

One of the central problems in the study of deep learning theory is to understand how the structure properties, such as depth, width and the number of nodes, affect the expressivity of deep neural networks. In this work, we show a new…

Machine Learning · Computer Science 2020-10-16 Kaifeng Bu , Yaobo Zhang , Qingxian Luo

The execution of graph algorithms using neural networks has recently attracted significant interest due to promising empirical progress. This motivates further understanding of how neural networks can replicate reasoning steps with…

Machine Learning · Computer Science 2024-10-03 Artur Back de Luca , Kimon Fountoulakis
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