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Attention mechanisms have become a popular component in deep neural networks, yet there has been little examination of how different influencing factors and methods for computing attention from these factors affect performance. Toward a…

Computer Vision and Pattern Recognition · Computer Science 2019-04-15 Xizhou Zhu , Dazhi Cheng , Zheng Zhang , Stephen Lin , Jifeng Dai

Sampling low-energy molecular conformations, spatial arrangements of atoms in a molecule, is a critical task for many different calculations performed in the drug discovery and optimization process. Numerous specialized equivariant networks…

Biomolecules · Quantitative Biology 2025-06-25 Viatcheslav Gurev , Timothy Rumbell

Attention mechanisms, which enable a neural network to accurately focus on all the relevant elements of the input, have become an essential component to improve the performance of deep neural networks. There are mainly two attention…

Computer Vision and Pattern Recognition · Computer Science 2021-02-02 Qing-Long Zhang Yu-Bin Yang

The attention mechanism within the transformer architecture enables the model to weigh and combine tokens based on their relevance to the query. While self-attention has enjoyed major success, it notably treats all queries $q$ in the same…

Machine Learning · Computer Science 2024-11-21 Xuechen Zhang , Xiangyu Chang , Mingchen Li , Amit Roy-Chowdhury , Jiasi Chen , Samet Oymak

We introduce a novel self-attention mechanism, which we call CSA (Chromatic Self-Attention), which extends the notion of attention scores to attention _filters_, independently modulating the feature channels. We showcase CSA in a…

Machine Learning · Computer Science 2023-04-24 Romain Menegaux , Emmanuel Jehanno , Margot Selosse , Julien Mairal

Transformer architecture has enabled recent progress in speech enhancement. Since Transformers are position-agostic, positional encoding is the de facto standard component used to enable Transformers to distinguish the order of elements in…

Audio and Speech Processing · Electrical Eng. & Systems 2024-02-15 Qiquan Zhang , Meng Ge , Hongxu Zhu , Eliathamby Ambikairajah , Qi Song , Zhaoheng Ni , Haizhou Li

Standard attention stores keys/values losslessly but reads them via a per-head convex average, blocking channel-wise selection. We propose the Free Energy Mixer (FEM): a free-energy (log-sum-exp) read that applies a value-driven,…

Computation and Language · Computer Science 2026-02-10 Jiecheng Lu , Shihao Yang

Attention regulates information transfer between tokens. For this, query and key vectors are compared, typically in terms of a scalar product, $\mathbf{Q}^T\mathbf{K}$, together with a subsequent softmax normalization. In geometric terms,…

Machine Learning · Computer Science 2025-08-11 Claudius Gros

Transformer architectures have achieved remarkable success across language, vision, and multimodal tasks, and there is growing demand for them to address in-context compositional learning tasks. In these tasks, models solve the target…

Machine Learning · Computer Science 2025-11-26 Wei Chen , Jingxi Yu , Zichen Miao , Qiang Qiu

Multi-head, key-value attention is the backbone of the widely successful Transformer model and its variants. This attention mechanism uses multiple parallel key-value attention blocks (called heads), each performing two fundamental…

Machine Learning · Computer Science 2022-02-15 Sarthak Mittal , Sharath Chandra Raparthy , Irina Rish , Yoshua Bengio , Guillaume Lajoie

Benefiting from the capability of building inter-dependencies among channels or spatial locations, attention mechanisms have been extensively studied and broadly used in a variety of computer vision tasks recently. In this paper, we…

Computer Vision and Pattern Recognition · Computer Science 2020-11-09 Diganta Misra , Trikay Nalamada , Ajay Uppili Arasanipalai , Qibin Hou

Relative Positional Encoding (RPE), which encodes the relative distance between any pair of tokens, is one of the most successful modifications to the original Transformer. As far as we know, theoretical understanding of the RPE-based…

Machine Learning · Computer Science 2022-10-31 Shengjie Luo , Shanda Li , Shuxin Zheng , Tie-Yan Liu , Liwei Wang , Di He

Selective attention helps us focus on task-relevant aspects in the constant flood of our sensory input. This constraint in our perception allows us to robustly generalize under distractions and to new compositions of perceivable concepts.…

Computer Vision and Pattern Recognition · Computer Science 2024-09-17 Ankit Vani , Bac Nguyen , Samuel Lavoie , Ranjay Krishna , Aaron Courville

Multi-head self-attention-based Transformers have shown promise in different learning tasks. Albeit these models exhibit significant improvement in understanding short-term and long-term contexts from sequences, encoders of Transformers and…

Computation and Language · Computer Science 2023-10-24 Ayan Sengupta , Md Shad Akhtar , Tanmoy Chakraborty

Sound event detection (SED) is an interesting but challenging task due to the scarcity of data and diverse sound events in real life. This paper presents a multi-grained based attention network (MGA-Net) for semi-supervised sound event…

Sound · Computer Science 2022-11-01 Ying Hu , Xiujuan Zhu , Yunlong Li , Hao Huang , Liang He

Transformer networks, driven by self-attention, are central to Large Language Models. In generative Transformers, self-attention uses cache memory to store token projections, avoiding recomputation at each time step. However, GPU-stored…

Neural and Evolutionary Computing · Computer Science 2024-11-26 Nathan Leroux , Paul-Philipp Manea , Chirag Sudarshan , Jan Finkbeiner , Sebastian Siegel , John Paul Strachan , Emre Neftci

Mixture-of-Experts (MoE) models improve transformer efficiency but lack a unified theoretical explanation, especially when both feed-forward and attention layers are allowed to specialize. To this end, we study the Mixture-of-Transformers…

Machine Learning · Computer Science 2025-11-03 Hongbo Li , Qinhang Wu , Sen Lin , Yingbin Liang , Ness B. Shroff

Transformers are built upon multi-head scaled dot-product attention and positional encoding, which aim to learn the feature representations and token dependencies. In this work, we focus on enhancing the distinctive representation by…

Computer Vision and Pattern Recognition · Computer Science 2022-07-12 Litao Yu , Jian Zhang

Position information is essential for language modeling. In softmax transformers, Rotary Position Embeddings (\textit{RoPE}) encode positions through \textit{fixed-angle} rotations, while in linear transformers, order is handled via…

Computation and Language · Computer Science 2026-04-27 Sajad Movahedi , Timur Carstensen , Arshia Afzal , Frank Hutter , Antonio Orvieto , Volkan Cevher

The attention mechanism is a core primitive in modern large language models (LLMs) and AI more broadly. Since attention by itself is permutation-invariant, position encoding is essential for modeling structured domains such as language.…

Computation and Language · Computer Science 2026-02-05 Songlin Yang , Yikang Shen , Kaiyue Wen , Shawn Tan , Mayank Mishra , Liliang Ren , Rameswar Panda , Yoon Kim
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