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Search is an ability foundational in many important tasks, and recent studies have shown that large language models (LLMs) struggle to perform search robustly. It is unknown whether this inability is due to a lack of data, insufficient…

Transductive tasks on graphs differ fundamentally from typical supervised machine learning tasks, as the independent and identically distributed (i.i.d.) assumption does not hold among samples. Instead, all train/test/validation samples are…

Machine Learning · Computer Science 2024-11-21 Hamed Shirzad , Honghao Lin , Ameya Velingker , Balaji Venkatachalam , David Woodruff , Danica Sutherland

Transformer-based models have demonstrated remarkable reasoning abilities, but the mechanisms underlying relational reasoning remain poorly understood. We investigate how transformers perform \textit{transitive inference}, a classic…

Machine Learning · Computer Science 2026-05-12 Jesse Geerts , Andrew Liu , Stephanie Chan , Claudia Clopath , Kimberly Stachenfeld

Transformers often fail to learn generalizable algorithms, instead relying on brittle heuristics. Using graph connectivity as a testbed, we explain this phenomenon both theoretically and empirically. We consider a simplified Transformer…

Machine Learning · Computer Science 2026-02-19 Qilin Ye , Deqing Fu , Robin Jia , Vatsal Sharan

We investigate the capabilities of transformer models on relational reasoning tasks. In these tasks, models are trained on a set of strings encoding abstract relations, and are then tested out-of-distribution on data that contains symbols…

Computation and Language · Computer Science 2024-04-17 Enric Boix-Adsera , Omid Saremi , Emmanuel Abbe , Samy Bengio , Etai Littwin , Joshua Susskind

Transformer models have recently gained popularity in graph representation learning as they have the potential to learn complex relationships beyond the ones captured by regular graph neural networks. The main research question is how to…

Machine Learning · Computer Science 2023-10-31 Yuankai Luo , Veronika Thost , Lei Shi

Which transformer scaling regimes are able to perfectly solve different classes of algorithmic problems? While tremendous empirical advances have been attained by transformer-based neural networks, a theoretical understanding of their…

Graph transformers are a recent advancement in machine learning, offering a new class of neural network models for graph-structured data. The synergy between transformers and graph learning demonstrates strong performance and versatility…

Machine Learning · Computer Science 2025-12-23 Ahsan Shehzad , Feng Xia , Shagufta Abid , Ciyuan Peng , Shuo Yu , Dongyu Zhang , Karin Verspoor

Transformers have revolutionized the field of machine learning. In particular, they can be used to solve complex algorithmic problems, including graph-based tasks. In such algorithmic tasks a key question is what is the minimal size of a…

Machine Learning · Computer Science 2026-01-29 Gilad Yehudai , Clayton Sanford , Maya Bechler-Speicher , Orr Fischer , Ran Gilad-Bachrach , Amir Globerson

We argue that Transformers are essentially graph-to-graph models, with sequences just being a special case. Attention weights are functionally equivalent to graph edges. Our Graph-to-Graph Transformer architecture makes this ability…

Computation and Language · Computer Science 2023-10-30 James Henderson , Alireza Mohammadshahi , Andrei C. Coman , Lesly Miculicich

Transformers flexibly operate over sets of real-valued vectors representing task-specific entities and their attributes, where each vector might encode one word-piece token and its position in a sequence, or some piece of information that…

Machine Learning · Computer Science 2023-03-14 Cameron Diao , Ricky Loynd

The incredible success of transformers on sequence modeling tasks can be largely attributed to the self-attention mechanism, which allows information to be transferred between different parts of a sequence. Self-attention allows…

Machine Learning · Computer Science 2024-08-14 Eshaan Nichani , Alex Damian , Jason D. Lee

Recent studies suggest that large language models (LLMs) possess the capability to solve graph reasoning tasks. Notably, even when graph structures are embedded within textual descriptions, LLMs can still effectively answer related…

Computation and Language · Computer Science 2025-10-21 Xinnan Dai , Kai Yang , Jay Revolinsky , Kai Guo , Aoran Wang , Bohang Zhang , Jiliang Tang

Transformer networks have seen great success in natural language processing and machine vision, where task objectives such as next word prediction and image classification benefit from nuanced context sensitivity across high-dimensional…

Machine Learning · Computer Science 2022-12-13 Yuxuan Li , James L. McClelland

Knowledge graph embedding models learn the representations of entities and relations in the knowledge graphs for predicting missing links (relations) between entities. Their effectiveness are deeply affected by the ability of modeling and…

Artificial Intelligence · Computer Science 2021-10-28 Tengwei Song , Jie Luo , Lei Huang

Large Language Models (LLMs) have achieved great success in various reasoning tasks. In this work, we focus on the graph reasoning ability of LLMs. Although theoretical studies proved that LLMs are capable of handling graph reasoning tasks,…

Computation and Language · Computer Science 2025-01-09 Xinnan Dai , Qihao Wen , Yifei Shen , Hongzhi Wen , Dongsheng Li , Jiliang Tang , Caihua Shan

The transformer architecture has shown remarkable success in various domains, such as natural language processing and computer vision. When it comes to graph learning, transformers are required not only to capture the interactions between…

Machine Learning · Computer Science 2024-01-30 Van Thuy Hoang , O-Joun Lee

Recent theoretical results show transformers cannot express sequential reasoning problems over long inputs, intuitively because their computational depth is bounded. However, prior work treats the depth as a constant, leaving it unclear to…

Machine Learning · Computer Science 2025-11-07 William Merrill , Ashish Sabharwal

Empirical studies have identified a range of learnability biases and limitations of transformers, such as a persistent difficulty in learning to compute simple formal languages such as PARITY, and a bias towards low-degree functions.…

Machine Learning · Computer Science 2024-05-28 Michael Hahn , Mark Rofin

Transformers, as the fundamental deep learning architecture, have demonstrated great capability in reasoning. This paper studies the generalizable first-order logical reasoning ability of transformers with their parameterized knowledge and…

Computation and Language · Computer Science 2025-07-11 Tianshi Zheng , Jiazheng Wang , Zihao Wang , Jiaxin Bai , Hang Yin , Zheye Deng , Yangqiu Song , Jianxin Li
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