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This paper presents a proof-of-concept method for classifying chemical compounds directly from NMR data without doing structure elucidation. This can help to reduce time in finding good structure candidates, as in most cases matching must…

Accurate prediction of nuclear magnetic resonance (NMR) chemical shifts is fundamental to spectral analysis and molecular structure elucidation, yet existing machine learning methods rely on limited, labor-intensive atom-assigned datasets.…

Machine Learning · Computer Science 2026-01-27 Yongqi Jin , Yecheng Wang , Jun-jie Wang , Rong Zhu , Guolin Ke , Weinan E

The irregular contour representation is one of the tough challenges in scene text detection. Although segmentation-based methods have achieved significant progress with the help of flexible pixel prediction, the overlap of geographically…

Computer Vision and Pattern Recognition · Computer Science 2024-09-26 Xu Han , Junyu Gao , Chuang Yang , Yuan Yuan , Qi Wang

Tandem mass spectra capture fragmentation patterns that provide key structural information about a molecule. Although mass spectrometry is applied in many areas, the vast majority of small molecules lack experimental reference spectra. For…

Machine Learning · Computer Science 2023-05-03 Adamo Young , Bo Wang , Hannes Röst

Multimodal semantic communication has great potential to enhance downstream task performance by integrating complementary information across modalities. This paper introduces ProMSC-MIS, a novel Prompt-based Multimodal Semantic…

Multimedia · Computer Science 2025-08-28 Haoshuo Zhang , Yufei Bo , Meixia Tao

Environmental Sound Classification (ESC) is an important and challenging problem, and feature representation is a critical and even decisive factor in ESC. Feature representation ability directly affects the accuracy of sound…

Sound · Computer Science 2019-08-19 Tianhao Qiao , Shunqing Zhang , Zhichao Zhang , Shan Cao , Shugong Xu

ElectrodeNet, a deep learning based sound coding strategy for the cochlear implant (CI), is proposed to emulate the advanced combination encoder (ACE) strategy by replacing the conventional envelope detection using various artificial neural…

Audio and Speech Processing · Electrical Eng. & Systems 2023-05-29 Enoch Hsin-Ho Huang , Rong Chao , Yu Tsao , Chao-Min Wu

Recent work has demonstrated that using a carefully designed sensing matrix rather than a random one, can improve the performance of compressed sensing. In particular, a well-designed sensing matrix can reduce the coherence between the…

Information Theory · Computer Science 2010-09-09 Kevin Rosenblum , Lihi Zelnik-Manor , Yonina C. Eldar

Learning from data has led to paradigm shifts in a multitude of disciplines, including web, text, and image search, speech recognition, as well as bioinformatics. Can machine learning enable similar breakthroughs in understanding quantum…

In this paper, we propose a novel concept for engineered molecular communication (MC) systems inspired by animal olfaction. We focus on a multi-user scenario where transmitters employ unique mixtures of different types of signaling…

Information Theory · Computer Science 2022-04-19 Vahid Jamali , Helene M. Loos , Andrea Buettner , Robert Schober , H. Vincent Poor

Multivariate time series forecasting requires models to simultaneously capture variable-wise structural dependencies and generalize across diverse tasks. While structural encoders are effective in modeling feature interactions, they lack…

Computation and Language · Computer Science 2025-06-26 Fengze Li , Yue Wang , Yangle Liu , Ming Huang , Dou Hong , Jieming Ma

Cross-modal retrieval across image and text modalities is a challenging task due to its inherent ambiguity: An image often exhibits various situations, and a caption can be coupled with diverse images. Set-based embedding has been studied…

Computer Vision and Pattern Recognition · Computer Science 2023-07-25 Dongwon Kim , Namyup Kim , Suha Kwak

Motivation: Network-based analyses of omics data are widely used, and while many of these methods have been adapted to single-cell scenarios, they often remain memory- and space-intensive. As a result, they are better suited to batch data…

Machine Learning · Computer Science 2025-04-16 Pedro Henrique da Costa Avelar , Min Wu , Sophia Tsoka

Link prediction in knowledge graphs requires integrating structural information and semantic context to infer missing entities. While large language models offer strong generative reasoning capabilities, their limited exploitation of…

Computation and Language · Computer Science 2025-09-09 Mengxue Yang , Chun Yang , Jiaqi Zhu , Jiafan Li , Jingqi Zhang , Yuyang Li , Ying Li

The annotation (assigning structural chemical identities) of MS/MS spectra remains a significant challenge due to the enormous molecular diversity in biological samples and the limited scope of reference databases. Currently, the vast…

Machine Learning · Computer Science 2025-04-30 Yinkai Wang , Xiaohui Chen , Liping Liu , Soha Hassoun

Sequence classification is the supervised learning task of building models that predict class labels of unseen sequences of symbols. Although accuracy is paramount, in certain scenarios interpretability is a must. Unfortunately, such…

Machine Learning · Computer Science 2020-06-26 Severin Gsponer , Luca Costabello , Chan Le Van , Sumit Pai , Christophe Gueret , Georgiana Ifrim , Freddy Lecue

Sign Language Translation (SLT) is a promising technology to bridge the communication gap between the deaf and the hearing people. Recently, researchers have adopted Neural Machine Translation (NMT) methods, which usually require…

Computation and Language · Computer Science 2023-03-22 Biao Fu , Peigen Ye , Liang Zhang , Pei Yu , Cong Hu , Yidong Chen , Xiaodong Shi

Open-vocabulary semantic segmentation enables models to segment objects or image regions beyond fixed class sets, offering flexibility in dynamic environments. However, existing methods often rely on single-view images and struggle with…

Computer Vision and Pattern Recognition · Computer Science 2026-04-20 Thomas Campagnolo , Ezio Malis , Philippe Martinet , Gaétan Bahl

Infrared (IR) spectroscopy is a pivotal technique in chemical research for elucidating molecular structures and dynamics through vibrational and rotational transitions. However, the intricate molecular fingerprints characterized by unique…

Machine Learning · Computer Science 2024-02-06 Chengchun Liu , Fanyang Mo

Interpreting neural activity through meaningful latent representations remains a complex and evolving challenge at the intersection of neuroscience and artificial intelligence. We investigate the potential of multimodal foundation models to…

Computation and Language · Computer Science 2025-04-22 Yijun Liu