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Deep neural networks are powerful tools to detect hidden patterns in data and leverage them to make predictions, but they are not designed to understand uncertainty and estimate reliable probabilities. In particular, they tend to be…

Machine Learning · Statistics 2022-11-10 Bat-Sheva Einbinder , Yaniv Romano , Matteo Sesia , Yanfei Zhou

Uncertainty estimation aims to evaluate the confidence of a trained deep neural network. However, existing uncertainty estimation approaches rely on low-dimensional distributional assumptions and thus suffer from the high dimensionality of…

Machine Learning · Computer Science 2023-10-26 Tsai Hor Chan , Kin Wai Lau , Jiajun Shen , Guosheng Yin , Lequan Yu

Transformers have become the go-to architecture for language and vision tasks, yet their theoretical properties, especially memorization capacity, remain elusive. This paper investigates the memorization abilities of multi-head attention…

Machine Learning · Computer Science 2024-03-05 Sadegh Mahdavi , Renjie Liao , Christos Thrampoulidis

Deep learning has shown remarkable success in the field of clustering recently. However, how to transfer a trained clustering model on a source domain to a target domain by leveraging the acquired knowledge to guide the clustering process…

Machine Learning · Computer Science 2023-10-10 Zheng Zhang , Liang Zhao

The self-attention mechanism, while foundational to modern Transformer architectures, suffers from a critical inefficiency: it frequently allocates substantial attention to redundant or noisy context. Differential Attention addressed this…

Transformers have been successfully used in various fields and are becoming the standard tools in computer vision. However, self-attention, a core component of transformers, has a quadratic complexity problem, which limits the use of…

Computer Vision and Pattern Recognition · Computer Science 2022-06-02 Jiuk Hong , Chaehyeon Lee , Soyoun Bang , Heechul Jung

Transformers are widely used deep learning architectures. Existing transformers are mostly designed for sequences (texts or time series), images or videos, and graphs. This paper proposes a novel transformer model for massive (up to a…

Machine Learning · Computer Science 2023-11-09 Wenchong He , Zhe Jiang , Tingsong Xiao , Zelin Xu , Shigang Chen , Ronald Fick , Miles Medina , Christine Angelini

The self-attention mechanism, a cornerstone of Transformer-based state-of-the-art deep learning architectures, is largely heuristic-driven and fundamentally challenging to interpret. Establishing a robust theoretical foundation to explain…

Computer Vision and Pattern Recognition · Computer Science 2026-02-10 Laziz U. Abdullaev , Maksim Tkachenko , Tan M. Nguyen

We propose a probabilistic interpretation of transformers as unrolled inference steps assuming a probabilistic Laplacian Eigenmaps model from the ProbDR framework. Our derivation shows that at initialisation, transformers perform "linear"…

Machine Learning · Computer Science 2025-07-29 Aditya Ravuri , Neil D. Lawrence

Self-attention mechanisms are foundational to Transformer architectures, supporting their impressive success in a wide range of tasks. While there are many self-attention variants, their robustness to noise and spurious correlations has not…

Machine Learning · Computer Science 2025-09-09 Camilo Tamayo-Rousseau , Yunjia Zhao , Yiqun Zhang , Randall Balestriero

Prior-data fitted networks (PFNs) have recently emerged as a powerful approach for Bayesian prediction tasks, approximating the posterior predictive distribution (PPD) through in-context learning. Despite their strong empirical performance…

Machine Learning · Statistics 2026-05-27 Gyeonghun Kang , Changwoo J. Lee , Xiang Cheng

Various forms of sparse attention have been explored to mitigate the quadratic computational and memory cost of the attention mechanism in transformers. We study sparse transformers not through a lens of efficiency but rather in terms of…

Machine Learning · Computer Science 2025-06-19 Parikshit Ram , Kenneth L. Clarkson , Tim Klinger , Shashanka Ubaru , Alexander G. Gray

Dynamic graph embedding has emerged as a very effective technique for addressing diverse temporal graph analytic tasks (i.e., link prediction, node classification, recommender systems, anomaly detection, and graph generation) in various…

Machine Learning · Computer Science 2023-12-27 Alan John Varghese , Aniruddha Bora , Mengjia Xu , George Em Karniadakis

The Transformer is an extremely powerful and prominent deep learning architecture. In this work, we challenge the commonly held belief in deep learning that going deeper is better, and show an alternative design approach that is building…

Machine Learning · Computer Science 2022-11-10 Jason Ross Brown , Yiren Zhao , Ilia Shumailov , Robert D Mullins

Deep learning methods have boosted the adoption of NLP systems in real-life applications. However, they turn out to be vulnerable to distribution shifts over time which may cause severe dysfunctions in production systems, urging…

Computation and Language · Computer Science 2022-11-28 Pierre Colombo , Eduardo D. C. Gomes , Guillaume Staerman , Nathan Noiry , Pablo Piantanida

We consider the problem of uncertainty estimation in the context of (non-Bayesian) deep neural classification. In this context, all known methods are based on extracting uncertainty signals from a trained network optimized to solve the…

Machine Learning · Computer Science 2019-04-25 Yonatan Geifman , Guy Uziel , Ran El-Yaniv

The transformer is the most popular neural architecture for language modeling. The cornerstone of the transformer is its global attention mechanism, which lets the model aggregate information from all preceding tokens before generating the…

Computation and Language · Computer Science 2026-05-20 Jiaoda Li , Ryan Cotterell

Transformer model with multi-head attention requires caching intermediate results for efficient inference in generation tasks. However, cache brings new memory-related costs and prevents leveraging larger batch size for faster speed. We…

Computation and Language · Computer Science 2021-06-15 Yu Yan , Jiusheng Chen , Weizhen Qi , Nikhil Bhendawade , Yeyun Gong , Nan Duan , Ruofei Zhang

Linear attention has attracted interest as a computationally efficient approximation to softmax attention, especially for long sequences. Recent studies have explored distilling softmax attention in pre-trained Transformers into linear…

Machine Learning · Computer Science 2025-07-08 Naoki Nishikawa , Rei Higuchi , Taiji Suzuki

Previous work on the learnability of transformers \textemdash\ focused primarily on examining their ability to approximate specific algorithmic patterns through training \textemdash\ has largely been data-driven, offering only probabilistic…

Machine Learning · Computer Science 2026-04-23 Debanjan Dutta , Anish Chakrabarty , Faizanuddin Ansari , Swagatam Das
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