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Predicting molecular ground-state conformation (i.e., energy-minimized conformation) is crucial for many chemical applications such as molecular docking and property prediction. Classic energy-based simulation is time-consuming when solving…

Biomolecules · Quantitative Biology 2025-05-23 Fanmeng Wang , Minjie Cheng , Hongteng Xu

The self-attention mechanism in Transformer architecture, invariant to sequence order, necessitates positional embeddings to encode temporal order in time series prediction. We argue that this reliance on positional embeddings restricts the…

Machine Learning · Computer Science 2024-08-21 Yongbo Yu , Weizhong Yu , Feiping Nie , Xuelong Li

The recently proposed Conformer architecture which combines convolution with attention to capture both local and global dependencies has become the \textit{de facto} backbone model for Automatic Speech Recognition~(ASR). Inherited from the…

Purpose: Long scan time in phase encoding for forming complete K-space matrices is a critical drawback of MRI, making patients uncomfortable and wasting important time for diagnosing emergent diseases. This paper aims to reducing the scan…

Computer Vision and Pattern Recognition · Computer Science 2022-03-14 Yiming Liu , Yanwei Pang , Ruiqi Jin , Zhenchang Wang

Transformer-based architectures are widely adopted in sequential recommendation systems, yet their application in Financial Services (FS) presents distinct practical and modeling challenges for real-time recommendation. These include:a)…

Machine Learning · Computer Science 2025-11-20 Dwipam Katariya , Snehita Varma , Akshat Shreemali , Benjamin Wu , Kalanand Mishra , Pranab Mohanty

Building on the success of diffusion models in visual generation, flow-based models reemerge as another prominent family of generative models that have achieved competitive or better performance in terms of both visual quality and inference…

Computer Vision and Pattern Recognition · Computer Science 2024-09-27 Wenliang Zhao , Minglei Shi , Xumin Yu , Jie Zhou , Jiwen Lu

Surface defect inspection is of great importance for industrial manufacture and production. Though defect inspection methods based on deep learning have made significant progress, there are still some challenges for these methods, such as…

Computer Vision and Pattern Recognition · Computer Science 2023-09-25 Xiaoheng Jiang , Kaiyi Guo , Yang Lu , Feng Yan , Hao Liu , Jiale Cao , Mingliang Xu , Dacheng Tao

Inter reader variability and cross site domain shift challenge the automatic segmentation of prostate anatomy using T2 weighted MRI images. This study investigates whether transformer models can retain precision amid such heterogeneity. We…

Image and Video Processing · Electrical Eng. & Systems 2026-04-23 Shatha Abudalou , Jung Choi , Yasin Yilmaz , Yoganand Balagurunathan

Spatiotemporal flows govern diverse phenomena across physics, biology, and engineering, yet modelling their multiscale dynamics remains a central challenge. Despite major advances in physics-informed machine learning, existing approaches…

Computational fluid dynamics (CFD) provides high-fidelity simulations of fluid flows but remains computationally expensive for many-query applications. In recent years deep learning (DL) has been used to construct data-driven fluid-dynamic…

Machine Learning · Computer Science 2026-04-13 David Ramos , Lucas Lacasa , Fermín Gutiérrez , Eusebio Valero , Gonzalo Rubio

Vision-Language Latent Diffusion Models (LDMs) (Rombach et al., 2022) provide powerful generative priors for inverse problems. However, existing LDM-based inverse solvers typically require a large number of neural function evaluations…

Machine Learning · Statistics 2026-05-11 Alessio Spagnoletti , Tim Y. J. Wang , Marcelo Pereyra , O. Deniz Akyildiz

Spiking Neural Networks (SNNs) offer notable advantages in biological plausibility and energy efficiency, making them promising candidates for building low-power Transformers. However, existing Spiking Transformers largely adhere to a…

Computer Vision and Pattern Recognition · Computer Science 2026-05-12 Zequan Xie , Weiming Zeng , Yunhua Chen , Sichang Ling , Tongyang Chen , Jinsheng Xiao

Multimode fibers (MMFs) can transmit multiple guided modes simultaneously, making them a promising platform for high-resolution biomedical imaging, endoscopy and high-bandwidth optical communication. However, their complex modal behavior,…

Optics · Physics 2026-05-28 Dvir Marsh , Lior Fridman , Stav Lotan , Amit Kam , Shie Mannor , Guy Bartal

A multi-fidelity regression model is proposed for combining multiple datasets with different fidelities, particularly abundant low-fidelity data and scarce high-fidelity observations. The model builds upon recent multi-fidelity frameworks…

Fluid Dynamics · Physics 2023-11-21 Mohammad Hossein Saadat

Accurate prediction of laminar-turbulent transition is a critical element of computational fluid dynamics simulations for aerodynamic design across multiple flow regimes. Traditional methods of transition prediction cannot be easily…

Fluid Dynamics · Physics 2021-06-17 Muhammad I. Zafar , Meelan M. Choudhari , Pedro Paredes , Heng Xiao

The use of machine learning in fluid dynamics is becoming more common to expedite the computation when solving forward and inverse problems of partial differential equations. Yet, a notable challenge with existing convolutional neural…

Fluid Dynamics · Physics 2024-05-10 Siming Shan , Pengkai Wang , Song Chen , Jiaxu Liu , Chao Xu , Shengze Cai

Flexible intelligent metasurfaces (FIMs) offer a new solution for wireless communications by introducing morphological degrees of freedom, dynamically morphing their three-dimensional shape to ensure multipath signals interfere…

Information Theory · Computer Science 2026-04-08 Jian Xiao , Ji Wang , Qimei Cui , Yucang Yang , Xingwang Li , Dusit Niyato , Chau Yuen

Accurate dose distribution prediction is crucial in the radiotherapy planning. Although previous methods based on convolutional neural network have shown promising performance, they have the problem of over-smoothing, leading to prediction…

Image and Video Processing · Electrical Eng. & Systems 2024-10-31 Xin Liao , Zhenghao Feng , Jianghong Xiao , Xingchen Peng , Yan Wang

Recurrent Neural Networks were, until recently, one of the best ways to capture the timely dependencies in sequences. However, with the introduction of the Transformer, it has been proven that an architecture with only attention-mechanisms…

Machine Learning · Computer Science 2021-08-19 Radostin Cholakov , Todor Kolev

Spiking neural networks (SNNs) offer an energy-efficient alternative to conventional deep learning by emulating the event-driven processing manner of the brain. Incorporating Transformers with SNNs has shown promise for accuracy. However,…

Neural and Evolutionary Computing · Computer Science 2024-09-05 Yuetong Fang , Ziqing Wang , Lingfeng Zhang , Jiahang Cao , Honglei Chen , Renjing Xu