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Graph neural networks (GNNs) are highly effective on a variety of graph-related tasks; however, they lack interpretability and transparency. Current explainability approaches are typically local and treat GNNs as black-boxes. They do not…

Machine Learning · Computer Science 2023-03-10 Han Xuanyuan , Pietro Barbiero , Dobrik Georgiev , Lucie Charlotte Magister , Pietro Lió

A recurrent neural network (RNN) is a universal approximator of dynamical systems, whose performance often depends on sensitive hyperparameters. Tuning of such hyperparameters may be difficult and, typically, based on a trial-and-error…

Neural and Evolutionary Computing · Computer Science 2017-02-22 Filippo Maria Bianchi , Lorenzo Livi , Cesare Alippi , Robert Jenssen

Computer-aided detection has been a research area attracting great interest in the past decade. Machine learning algorithms have been utilized extensively for this application as they provide a valuable second opinion to the doctors.…

Modern deep networks are highly complex and their inferential outcome very hard to interpret. This is a serious obstacle to their transparent deployment in safety-critical or bias-aware applications. This work contributes to post-hoc…

Computer Vision and Pattern Recognition · Computer Science 2023-10-10 Konstantinos P. Panousis , Sotirios Chatzis

Despite their increasing popularity and success in a variety of supervised learning problems, deep neural networks are extremely hard to interpret and debug: Given and already trained Deep Neural Net, and a set of test inputs, how can we…

Machine Learning · Computer Science 2018-06-07 Uday Singh Saini , Evangelos E. Papalexakis

Visual scenes are naturally organized in a hierarchy, where a coarse semantic is recursively comprised of several fine details. Exploring such a visual hierarchy is crucial to recognize the complex relations of visual elements, leading to a…

Computer Vision and Pattern Recognition · Computer Science 2024-04-02 Hyeongjun Kwon , Jinhyun Jang , Jin Kim , Kwonyoung Kim , Kwanghoon Sohn

Emergence of deep neural networks (DNNs) has raised enormous attention towards artificial neural networks (ANNs) once again. They have become the state-of-the-art models and have won different machine learning challenges. Although these…

Neural and Evolutionary Computing · Computer Science 2022-12-09 Shahriar Rezghi Shirsavar , Abdol-Hossein Vahabie , Mohammad-Reza A. Dehaqani

Graph Neural Networks (GNNs) have emerged as a powerful and flexible framework for representation learning on irregular data. As they generalize the operations of classical CNNs on grids to arbitrary topologies, GNNs also bring much of the…

Machine Learning · Computer Science 2021-03-31 Mehdi Bahri , Gaétan Bahl , Stefanos Zafeiriou

Graph neural networks (GNNs), as topology/structure-aware models within deep learning, have emerged as powerful tools for AI-aided drug discovery (AIDD). By directly operating on molecular graphs, GNNs offer an intuitive and expressive…

Biomolecules · Quantitative Biology 2025-06-10 Odin Zhang , Haitao Lin , Xujun Zhang , Xiaorui Wang , Zhenxing Wu , Qing Ye , Weibo Zhao , Jike Wang , Kejun Ying , Yu Kang , Chang-yu Hsieh , Tingjun Hou

This paper proposes a deep Convolutional Neural Network(CNN) with strong generalization ability for structural topology optimization. The architecture of the neural network is made up of encoding and decoding parts, which provide down- and…

Machine Learning · Computer Science 2020-04-01 Yiquan Zhang , Bo Peng , Xiaoyi Zhou , Cheng Xiang , Dalei Wang

Graph neural networks trained to predict observable dynamics can be used to decompose the temporal activity of complex heterogeneous systems into simple, interpretable representations. Here we apply this framework to simulated neural…

Neurons and Cognition · Quantitative Biology 2026-02-17 Cédric Allier , Larissa Heinrich , Magdalena Schneider , Stephan Saalfeld

Deep Recurrent Neural Network (RNN) has gained popularity in many sequence classification tasks. Beyond predicting a correct class for each data instance, data scientists also want to understand what differentiating factors in the data have…

Machine Learning · Computer Science 2019-01-18 Chuan Wang , Takeshi Onishi , Keiichi Nemoto , Kwan-Liu Ma

Recently, Deep Neural Networks (DNNs) have emerged as the dominant model across various AI applications. In the era of IoT and mobile systems, the efficient deployment of DNNs on embedded platforms is vital to enable the development of…

Computer Vision and Pattern Recognition · Computer Science 2018-06-25 Stylianos I. Venieris , Alexandros Kouris , Christos-Savvas Bouganis

A fundamental challenge in neuroscience is to understand what structure in the world is represented in spatially distributed patterns of neural activity from multiple single-trial measurements. This is often accomplished by learning a…

Neural and Evolutionary Computing · Computer Science 2020-07-01 Jesse A. Livezey , Kristofer E. Bouchard , Edward F. Chang

Support vector machine (SVM) based multivariate pattern analysis (MVPA) has delivered promising performance in decoding specific task states based on functional magnetic resonance imaging (fMRI) of the human brain. Conventionally, the…

A computational graph in a deep neural network (DNN) denotes a specific data flow diagram (DFD) composed of many tensors and operators. Existing toolkits for visualizing computational graphs are not applicable when the structure is highly…

Human-Computer Interaction · Computer Science 2023-01-02 Rusheng Pan , Zhiyong Wang , Yating Wei , Han Gao , Gongchang Ou , Caleb Chen Cao , Jingli Xu , Tong Xu , Wei Chen

Deep Neural Networks (DNNs) deliver state-of-the-art performance in many image recognition and understanding applications. However, despite their outstanding performance, these models are black-boxes and it is hard to understand how they…

Computer Vision and Pattern Recognition · Computer Science 2019-08-14 Moustafa Alzantot , Amy Widdicombe , Simon Julier , Mani Srivastava

This paper addresses the challenge of navigation in large, visually complex environments with sparse rewards. We propose a method that uses object-oriented macro actions grounded in a topological map, allowing a simple Deep Q-Network (DQN)…

Machine Learning · Computer Science 2025-04-28 Simon Hakenes , Tobias Glasmachers

Inspired by research in psychology, we introduce a behavioral approach for visual navigation using topological maps. Our goal is to enable a robot to navigate from one location to another, relying only on its visual input and the…

Computer Vision and Pattern Recognition · Computer Science 2019-03-04 Kevin Chen , Juan Pablo de Vicente , Gabriel Sepulveda , Fei Xia , Alvaro Soto , Marynel Vazquez , Silvio Savarese

Deep neural networks (DNNs) have shown very promising results for various image restoration (IR) tasks. However, the design of network architectures remains a major challenging for achieving further improvements. While most existing…

Computer Vision and Pattern Recognition · Computer Science 2020-10-28 Weisheng Dong , Peiyao Wang , Wotao Yin , Guangming Shi , Fangfang Wu , Xiaotong Lu