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Mechanistic interpretability is an emerging diagnostic approach for neural models that has gained traction in broader natural language processing domains. This paradigm aims to provide attribution to components of neural systems where…

Information Retrieval · Computer Science 2025-01-20 Andrew Parry , Catherine Chen , Carsten Eickhoff , Sean MacAvaney

Feature selection of high-dimensional labeled data with limited observations is critical for making powerful predictive modeling accessible, scalable, and interpretable for domain experts. Spectroscopy data, which records the interaction…

Machine Learning · Computer Science 2022-02-10 Frantishek Akulich , Hadis Anahideh , Manaf Sheyyab , Dhananjay Ambre

One-dimensional nuclear magnetic resonance (NMR) spectroscopy is essential for molecular structure elucidation in organic synthesis, drug discovery, natural product characterization, and metabolomics, yet its interpretation remains heavily…

Recent advances in Remote Sensing Foundation Models (RSFMs) have led to significant breakthroughs in the field. While many RSFMs have been pretrained with massive optical imagery, more multispectral/hyperspectral data remain lack of the…

Computer Vision and Pattern Recognition · Computer Science 2025-08-05 Yuxiang Zhang , Wei Li , Mengmeng Zhang , Jiawei Han , Ran Tao , Shunlin Liang

Nuclear Magnetic Resonance (NMR) spectroscopy is one of the most powerful and widely used tools for molecular structure elucidation in organic chemistry. However, the interpretation of NMR spectra to determine unknown molecular structures…

Chemical Physics · Physics 2025-09-03 Yongqi Jin , Jun-Jie Wang , Fanjie Xu , Xiaohong Ji , Zhifeng Gao , Linfeng Zhang , Guolin Ke , Rong Zhu , Weinan E

Current and upcoming generations of visible-shortwave infrared (VSWIR) imaging spectrometers promise unprecedented capacity to quantify Earth System processes across the globe. However, reliable cloud screening remains a fundamental…

Machine Learning · Computer Science 2025-07-08 Jake H. Lee , Michael Kiper , David R. Thompson , Philip G. Brodrick

Accurate and interpretable survival analysis remains a core challenge in oncology. With growing multimodal data and the clinical need for transparent models to support validation and trust, this challenge increases in complexity. We propose…

Artificial Intelligence · Computer Science 2025-09-29 Mafalda Malafaia , Peter A. N. Bosman , Coen Rasch , Tanja Alderliesten

Multimodal recommendation aims to integrate collaborative signals with heterogeneous content such as visual and textual information, but remains challenged by modality-specific noise, semantic inconsistency, and unstable propagation over…

Information Retrieval · Computer Science 2026-02-02 Wei Yang , Rui Zhong , Yiqun Chen , Chi Lu , Peng Jiang

The Intelligent Fault Diagnosis of rotating machinery currently proposes some captivating challenges. Although results achieved by artificial intelligence and deep learning constantly improve, this field is characterized by several open…

Signal Processing · Electrical Eng. & Systems 2022-07-26 Eugenio Brusa , Cristiana Delprete , Luigi Gianpio Di Maggio

Molecular structure elucidation from spectroscopic data is a long-standing challenge in Chemistry, traditionally requiring expert interpretation. We introduce NMIRacle, a two-stage generative framework that builds upon recent paradigms in…

Chemical Physics · Physics 2026-03-12 Federico Ottomano , Yingzhen Li , Alex M. Ganose

Hyperspectral sensors capture dense spectra per pixel but suffer from low spatial resolution, causing blurred boundaries and mixed-pixel effects. Co-registered companion sensors such as multispectral, RGB, or panchromatic cameras provide…

Computer Vision and Pattern Recognition · Computer Science 2026-05-22 Ritik Shah , Marco F Duarte

We introduce Spectral NSR, a fully spectral neuro-symbolic reasoning framework that embeds logical rules as spectral templates and performs inference directly in the graph spectral domain. By leveraging graph signal processing (GSP) and…

Artificial Intelligence · Computer Science 2025-09-10 Andrew Kiruluta , Priscilla Burity

One-dimensional NMR spectroscopy is one of the most widely used techniques for the characterization of organic compounds and natural products. For molecules with up to 36 non-hydrogen atoms, the number of possible structures has been…

Neural Radiance Field (NeRF)-based segmentation methods focus on object semantics and rely solely on RGB data, lacking intrinsic material properties. This limitation restricts accurate material perception, which is crucial for robotics,…

Image and Video Processing · Electrical Eng. & Systems 2025-08-07 Fabian Perez , Sara Rojas , Carlos Hinojosa , Hoover Rueda-Chacón , Bernard Ghanem

Small-molecule identification from tandem mass spectrometry (MS/MS) remains a bottleneck in untargeted settings where spectral libraries are incomplete. While deep learning offers a solution, current approaches typically fall into two…

Machine Learning · Computer Science 2026-03-05 Yinkai Wang , Yan Zhou Chen , Xiaohui Chen , Li-Ping Liu , Soha Hassoun

Traditional sequential recommendation (SR) models learn low-dimensional item ID embeddings from user-item interactions, often overlooking textual information such as item titles or descriptions. Recent advances in Large Language Models…

Information Retrieval · Computer Science 2026-04-27 Yu Cui , Feng Liu , Zhaoxiang Wang , Changwang Zhang , Jun Wang , Can Wang , Jiawei Chen

Accurate visual understanding is imperative for advancing autonomous systems and intelligent robots. Despite the powerful capabilities of vision-language models (VLMs) in processing complex visual scenes, precisely recognizing obscured or…

Computer Vision and Pattern Recognition · Computer Science 2024-06-03 Huaxiang Zhang , Yaojia Mu , Guo-Niu Zhu , Zhongxue Gan

Ferromagnetic resonance (FMR) spectroscopy is a powerful method for quantifying internal magnetic anisotropy fields in nanoparticles, which is important in a wide range of biomedical and storage applications. The interpretation of FMR…

Materials Science · Physics 2022-06-02 David Slay , Michalis Charilaou

Nuclear magnetic resonance (NMR) spectroscopy is a powerful method for the investigation of three-dimensional structures of biological molecules such as proteins. Determining a protein structure is essential for understanding its function…

Artificial Intelligence · Computer Science 2015-06-22 John Emmons , Steven Johnson , Timothy Urness , Adina Kilpatrick

To tackle interpretability in deep learning, we present a novel framework to jointly learn a predictive model and its associated interpretation model. The interpreter provides both local and global interpretability about the predictive…

Machine Learning · Computer Science 2022-02-24 Jayneel Parekh , Pavlo Mozharovskyi , Florence d'Alché-Buc