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The training and generalization dynamics of the Transformer's core mechanism, namely the Attention mechanism, remain under-explored. Besides, existing analyses primarily focus on single-head attention. Inspired by the demonstrated benefits…

Machine Learning · Computer Science 2024-10-15 Puneesh Deora , Rouzbeh Ghaderi , Hossein Taheri , Christos Thrampoulidis

Multi-head attention plays a crucial role in the recent success of Transformer models, which leads to consistent performance improvements over conventional attention in various applications. The popular belief is that this effectiveness…

Computation and Language · Computer Science 2021-06-18 Liyuan Liu , Jialu Liu , Jiawei Han

Attention layers are widely used in natural language processing (NLP) and are beginning to influence computer vision architectures. Training very large transformer models allowed significant improvement in both fields, but once trained,…

Machine Learning · Computer Science 2021-05-21 Jean-Baptiste Cordonnier , Andreas Loukas , Martin Jaggi

We present a theoretical analysis of the performance of transformer with softmax attention in in-context learning with linear regression tasks. While the existing literature predominantly focuses on the convergence of transformers with…

Machine Learning · Computer Science 2024-02-01 Yingqian Cui , Jie Ren , Pengfei He , Jiliang Tang , Yue Xing

Attention is a powerful and ubiquitous mechanism for allowing neural models to focus on particular salient pieces of information by taking their weighted average when making predictions. In particular, multi-headed attention is a driving…

Computation and Language · Computer Science 2019-11-05 Paul Michel , Omer Levy , Graham Neubig

Transformers have reshaped machine learning by utilizing attention mechanisms to capture complex patterns in large datasets, leading to significant improvements in performance. This success has contributed to the belief that "bigger means…

Machine Learning · Computer Science 2025-05-28 Hemanth Saratchandran , Damien Teney , Simon Lucey

Despite the remarkable success of transformer-based models in various real-world tasks, their underlying mechanisms remain poorly understood. Recent studies have suggested that transformers can implement gradient descent as an in-context…

Machine Learning · Computer Science 2024-08-09 Xingwu Chen , Lei Zhao , Difan Zou

Graph foundation models using graph neural networks promise sustainable, efficient atomistic modeling. To tackle challenges of processing multi-source, multi-fidelity data during pre-training, recent studies employ multi-task learning, in…

Uncovering hidden graph structures underlying real-world data is a critical challenge with broad applications across scientific domains. Recently, transformer-based models leveraging the attention mechanism have demonstrated strong…

Machine Learning · Computer Science 2025-10-31 Yuan Cheng , Yu Huang , Zhe Xiong , Yingbin Liang , Vincent Y. F. Tan

Multi-graph learning is crucial for extracting meaningful signals from collections of heterogeneous graphs. However, effectively integrating information across graphs with differing topologies, scales, and semantics, often in the absence of…

Machine Learning · Computer Science 2026-02-02 Zahra Moslemi , Ziyi Liang , Norbert Fortin , Babak Shahbaba

As training billion-scale transformers becomes increasingly common, employing multiple distributed GPUs along with parallel training methods has become a standard practice. However, existing transformer designs suffer from significant…

Machine Learning · Computer Science 2025-12-09 Gyudong Kim , Hyukju Na , Jin Hyeon Kim , Hyunsung Jang , Jaemin Park , Jaegi Hwang , Namkoo Ha , Seungryong Kim , Young Geun Kim

Unsupervised Multiplex Graph Learning (UMGL) aims to learn node representations on various edge types without manual labeling. However, existing research overlooks a key factor: the reliability of the graph structure. Real-world data often…

Machine Learning · Computer Science 2024-09-27 Zhixiang Shen , Shuo Wang , Zhao Kang

Despite that going deep has proven successful in many neural architectures, the existing graph transformers are relatively shallow. In this work, we explore whether more layers are beneficial to graph transformers, and find that current…

Machine Learning · Computer Science 2023-03-02 Haiteng Zhao , Shuming Ma , Dongdong Zhang , Zhi-Hong Deng , Furu Wei

Pre-trained language models (PLM) have demonstrated their effectiveness for a broad range of information retrieval and natural language processing tasks. As the core part of PLM, multi-head self-attention is appealing for its ability to…

Computation and Language · Computer Science 2022-04-07 Shanshan Wang , Zhumin Chen , Zhaochun Ren , Huasheng Liang , Qiang Yan , Pengjie Ren

Transformer-based models have emerged as a leading architecture for natural language processing, natural language generation, and image generation tasks. A fundamental element of the transformer architecture is self-attention, which allows…

Machine Learning · Computer Science 2025-07-01 Venmugil Elango

Multi-head attention is appealing for its ability to jointly extract different types of information from multiple representation subspaces. Concerning the information aggregation, a common practice is to use a concatenation followed by a…

Computation and Language · Computer Science 2019-04-08 Jian Li , Baosong Yang , Zi-Yi Dou , Xing Wang , Michael R. Lyu , Zhaopeng Tu

Transformer-based models, even though achieving super-human performance on several downstream tasks, are often regarded as a black box and used as a whole. It is still unclear what mechanisms they have learned, especially their core module:…

Computation and Language · Computer Science 2023-10-17 Chong Li , Shaonan Wang , Yunhao Zhang , Jiajun Zhang , Chengqing Zong

We show that a constant number of self-attention layers can efficiently simulate, and be simulated by, a constant number of communication rounds of Massively Parallel Computation. As a consequence, we show that logarithmic depth is…

Machine Learning · Computer Science 2024-02-15 Clayton Sanford , Daniel Hsu , Matus Telgarsky

We study how multi-head softmax attention models are trained to perform in-context learning on linear data. Through extensive empirical experiments and rigorous theoretical analysis, we demystify the emergence of elegant attention patterns:…

Machine Learning · Computer Science 2025-05-29 Jianliang He , Xintian Pan , Siyu Chen , Zhuoran Yang

Multi-head attention layers, as used in the Transformer neural sequence model, are a powerful alternative to RNNs for moving information across and between sequences. While training these layers is generally fast and simple, due to…

Neural and Evolutionary Computing · Computer Science 2019-11-07 Noam Shazeer
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