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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…
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…
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,…
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…
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…
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…
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…
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…
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…
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…
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…
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…
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…
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…
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…
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:…
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…
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:…
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…