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Transforming CO$_2$ into methanol represents a crucial step towards closing the carbon cycle, with thermoreduction technology nearing industrial application. However, obtaining high methanol yields and ensuring the stability of…

Chemical Physics · Physics 2025-07-08 Prajwal Pisal , Ondrej Krejci , Patrick Rinke

Explainable artificial intelligence (XAI) methods shed light on the predictions of machine learning algorithms. Several different approaches exist and have already been applied in climate science. However, usually missing ground truth…

Machine Learning · Computer Science 2024-03-25 Philine Bommer , Marlene Kretschmer , Anna Hedström , Dilyara Bareeva , Marina M. -C. Höhne

While deep neural network models offer unmatched classification performance, they are prone to learning spurious correlations in the data. Such dependencies on confounding information can be difficult to detect using performance metrics if…

Machine Learning · Computer Science 2023-08-09 Susu Sun , Lisa M. Koch , Christian F. Baumgartner

Indecipherable black boxes are common in machine learning (ML), but applications increasingly require explainable artificial intelligence (XAI). The core of XAI is to establish transparent and interpretable data-driven algorithms. This work…

Optimization and Control · Mathematics 2023-06-13 Howard Heaton , Samy Wu Fung

Explainable artificial intelligence (XAI) aims to help human decision-makers in understanding complex machine learning (ML) models. One of the hallmarks of XAI are measures of relative feature importance, which are theoretically justified…

Artificial Intelligence · Computer Science 2024-02-12 Joao Marques-Silva , Xuanxiang Huang

The recent spike in certified Artificial Intelligence (AI) tools for healthcare has renewed the debate around adoption of this technology. One thread of such debate concerns Explainable AI (XAI) and its promise to render AI devices more…

Artificial Intelligence · Computer Science 2023-02-27 Giovanni Cinà , Tabea E. Röber , Rob Goedhart , Ş. İlker Birbil

This paper investigates the application of eXplainable Artificial Intelligence (XAI) in the design of embedded systems using machine learning (ML). As a case study, it addresses the challenging problem of static silent store prediction.…

Machine Learning · Computer Science 2024-03-08 Abdoulaye Gamatié , Yuyang Wang

Explainable AI (XAI) methods like SHAP and LIME produce numerical feature attributions that remain inaccessible to non expert users. Prior work has shown that Large Language Models (LLMs) can transform these outputs into natural language…

Computation and Language · Computer Science 2026-03-16 Fabian Lukassen , Jan Herrmann , Christoph Weisser , Benjamin Saefken , Thomas Kneib

We examined whether embedding human attention knowledge into saliency-based explainable AI (XAI) methods for computer vision models could enhance their plausibility and faithfulness. We first developed new gradient-based XAI methods for…

Computer Vision and Pattern Recognition · Computer Science 2023-05-08 Guoyang Liu , Jindi Zhang , Antoni B. Chan , Janet H. Hsiao

Predictive business process monitoring (PPM) has been around for several years as a use case of process mining. PPM enables foreseeing the future of a business process through predicting relevant information about how a running process…

Artificial Intelligence · Computer Science 2022-02-17 Ghada Elkhawaga , Mervat Abuelkheir , Manfred Reichert

Explainable AI (XAI) is critical for ensuring transparency, accountability, and trust in machine learning systems as black-box models are increasingly deployed within high-stakes domains. Among XAI methods, Shapley values are widely used…

Machine Learning · Computer Science 2025-02-19 Jiaxin Xu , Hung Chau , Angela Burden

Humour styles can have either a negative or a positive impact on well-being. Given the importance of these styles to mental health, significant research has been conducted on their automatic identification. However, the automated machine…

Computation and Language · Computer Science 2025-04-09 Mary Ogbuka Kenneth , Foaad Khosmood , Abbas Edalat

While machine learning (ML) models have been able to achieve unprecedented accuracies across various prediction tasks in quantum chemistry, it is now apparent that accuracy on a test set alone is not a guarantee for robust chemical modeling…

Explainable AI (XAI) methods are frequently applied to obtain qualitative insights about deep models' predictions. However, such insights need to be interpreted by a human observer to be useful. In this paper, we aim to use explanations…

Computer Vision and Pattern Recognition · Computer Science 2022-10-24 Sunsheng Gu , Vahdat Abdelzad , Krzysztof Czarnecki

Explainable artificial intelligence (XAI) has become increasingly important in biomedical image analysis to promote transparency, trust, and clinical adoption of DL models. While several surveys have reviewed XAI techniques, they often lack…

Computer Vision and Pattern Recognition · Computer Science 2025-07-11 Getamesay Haile Dagnaw , Yanming Zhu , Muhammad Hassan Maqsood , Wencheng Yang , Xingshuai Dong , Xuefei Yin , Alan Wee-Chung Liew

Deep learning techniques have revolutionized image classification by mimicking human cognition and automating complex decision-making processes. However, the deployment of AI systems in the wild, especially in high-security domains such as…

Computer Vision and Pattern Recognition · Computer Science 2024-09-24 Purushothaman Natarajan , Athira Nambiar

Machine learning methods have been remarkably successful in material science, providing novel scientific insights, guiding future laboratory experiments, and accelerating materials discovery. Despite the promising performance of these…

Machine Learning · Computer Science 2024-11-04 Sichao Li , Xin Wang , Amanda Barnard

There has been a recent surge in the field of Explainable AI (XAI) which tackles the problem of providing insights into the behavior of black-box machine learning models. Within this field, \textit{feature attribution} encompasses methods…

Hardware Architecture · Computer Science 2022-10-21 Ashwin Bhat , Adou Sangbone Assoa , Arijit Raychowdhury

Despite the fact that Artificial Intelligence (AI) has boosted the achievement of remarkable results across numerous data analysis tasks, however, this is typically accompanied by a significant shortcoming in the exhibited transparency and…

We share observations and challenges from an ongoing effort to implement Explainable AI (XAI) in a domain-specific workflow for cybersecurity analysts. Specifically, we briefly describe a preliminary case study on the use of XAI for source…

Human-Computer Interaction · Computer Science 2024-08-12 Ashley Suh , Harry Li , Caitlin Kenney , Kenneth Alperin , Steven R. Gomez