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We consider feature representation learning problem of molecular graphs. Graph Neural Networks have been widely used in feature representation learning of molecular graphs. However, most existing methods deal with molecular graphs…

Machine Learning · Computer Science 2022-06-08 Zhaoning Yu , Hongyang Gao

This study significantly advances multi-texture synthesis using Neural Cellular Automata (NCAs) by introducing a novel training methodology that enables robust self-regeneration of textures in damaged regions. This inherent healing…

Neural and Evolutionary Computing · Computer Science 2026-05-14 Mirela-Magdalena Catrina , Ioana Cristina Plajer , Alexandra Băicoianu

Multi-hop question answering over hybrid table-text data requires retrieving and reasoning across multiple evidence pieces from large corpora, but standard Retrieval-Augmented Generation (RAG) pipelines process documents as flat ranked…

Computation and Language · Computer Science 2026-01-13 Mohamed Sharafath , Aravindh Annamalai , Ganesh Murugan , Aravindakumar Venugopalan

Accurate identification of protein-nucleotide binding sites is fundamental to deciphering molecular mechanisms and accelerating drug discovery. However, current computational methods often struggle with suboptimal performance due to…

Machine Learning · Computer Science 2026-03-17 Yiming Gao , Liuyi Xu , Pengshan Cui , Yining Qian , An-Yang Lu , Xianpeng Wang

Graph-learning algorithms can fail when graph structure is adversarially perturbed, intrinsically noisy or constructed from imperfect observations. Here we show that some nodes bear much greater responsibility than others for allowing…

Machine Learning · Computer Science 2026-05-21 Yongyu Wang

In this paper, we propose a new paradigm to learn audio features for Music Structure Analysis (MSA). We train a deep encoder to learn features such that the Self-Similarity-Matrix (SSM) resulting from those approximates a ground-truth SSM.…

Sound · Computer Science 2022-11-16 Geoffroy Peeters , Florian Angulo

Representations for black-box optimisation methods (such as evolutionary algorithms) are traditionally constructed using a delicate manual process. This is in contrast to the representation that maps DNAs to phenotypes in biological…

Neural and Evolutionary Computing · Computer Science 2024-07-08 Milton L. Montero , Erwan Plantec , Eleni Nisioti , Joachim W. Pedersen , Sebastian Risi

While Graph Neural Networks (GNNs) recently became powerful tools in graph learning tasks, considerable efforts have been spent on improving GNNs' structural encoding ability. A particular line of work proposed subgraph GNNs that use…

Machine Learning · Computer Science 2023-10-31 Lecheng Kong , Jiarui Feng , Hao Liu , Dacheng Tao , Yixin Chen , Muhan Zhang

In this work, we dive deep into the impact of additive noise in pre-training deep networks. While various methods have attempted to use additive noise inspired by the success of latent denoising diffusion models, when used in combination…

Computer Vision and Pattern Recognition · Computer Science 2024-12-30 Hyesong Choi , Daeun Kim , Sungmin Cha , Kwang Moo Yi , Dongbo Min

Graph structure learning aims to learn connectivity in a graph from data. It is particularly important for many computer vision related tasks since no explicit graph structure is available for images for most cases. A natural way to…

Computer Vision and Pattern Recognition · Computer Science 2022-12-26 Yaohua Wang , FangYi Zhang , Ming Lin , Senzhang Wang , Xiuyu Sun , Rong Jin

Dynamic graph clustering aims to detect and track time-varying clusters in dynamic graphs, revealing the evolutionary mechanisms of complex real-world dynamic systems. Matrix factorization-based methods are promising approaches for this…

Machine Learning · Computer Science 2025-02-11 Dongyuan Li , Satoshi Kosugi , Ying Zhang , Manabu Okumura , Feng Xia , Renhe Jiang

Using single-task deep learning methods to reconstruct Magnetic Resonance Imaging (MRI) data acquired with different imaging sequences is inherently challenging. The trained deep learning model typically lacks generalizability, and the…

Image and Video Processing · Electrical Eng. & Systems 2024-04-23 Wanyu Bian , Albert Jang , Fang Liu

We propose a new training algorithm, ScanMix, that explores semantic clustering and semi-supervised learning (SSL) to allow superior robustness to severe label noise and competitive robustness to non-severe label noise problems, in…

Computer Vision and Pattern Recognition · Computer Science 2022-10-18 Ragav Sachdeva , Filipe R Cordeiro , Vasileios Belagiannis , Ian Reid , Gustavo Carneiro

Functional magnetic resonance imaging (fMRI) analysis faces significant challenges due to limited dataset sizes and domain variability between studies. Traditional self-supervised learning methods inspired by computer vision often rely on…

Image and Video Processing · Electrical Eng. & Systems 2025-10-08 Jakub Frac , Alexander Schmatz , Qiang Li , Guido Van Wingen , Shujian Yu

Recent works leveraging Graph Neural Networks to approach graph matching tasks have shown promising results. Recent progress in learning discrete distributions poses new opportunities for learning graph matching models. In this work, we…

Machine Learning · Computer Science 2021-09-14 Linfeng Liu , Michael C. Hughes , Soha Hassoun , Li-Ping Liu

Generalized Additive Models (GAMs) balance predictive accuracy and interpretability, but manually configuring their structure is challenging. We propose using the multi-objective genetic algorithm NSGA-II to automatically optimize GAMs,…

Machine Learning · Computer Science 2026-02-19 Kaaustaaub Shankar , Kelly Cohen

In recent years, research on learning with noisy labels has focused on devising novel algorithms that can achieve robustness to noisy training labels while generalizing to clean data. These algorithms often incorporate sophisticated…

Machine Learning · Computer Science 2023-07-12 Hui Kang , Sheng Liu , Huaxi Huang , Jun Yu , Bo Han , Dadong Wang , Tongliang Liu

Class Activation Maps (CAMs) are one of the important methods for visualizing regions used by deep learning models. Yet their robustness to different noise remains underexplored. In this work, we evaluate and report the resilience of…

Computer Vision and Pattern Recognition · Computer Science 2025-08-26 Syamantak Sarkar , Revoti P. Bora , Bhupender Kaushal , Sudhish N George , Kiran Raja

Multi-label image classification has generated significant interest in recent years and the performance of such systems often suffers from the not so infrequent occurrence of incorrect or missing labels in the training data. In this paper,…

Computer Vision and Pattern Recognition · Computer Science 2020-05-05 Zhuolin Jiang , Jan Silovsky , Man-Hung Siu , William Hartmann , Herbert Gish , Sancar Adali

While robust graph neural networks (GNNs) have been widely studied for graph perturbation and attack, those for label noise have received significantly less attention. Most existing methods heavily rely on the label smoothness assumption to…

Machine Learning · Computer Science 2023-11-07 Qingqing Ge , Jianxiang Yu , Zeyuan Zhao , Xiang Li