Related papers: Explaining reaction coordinates of alanine dipepti…

We propose a cross-entropy minimization method for finding the reaction coordinate from a large number of collective variables in complex molecular systems. This method is an extension of the likelihood maximization approach describing the…

eXplainable artificial intelligence (XAI) methods have emerged to convert the black box of machine learning (ML) models into a more digestible form. These methods help to communicate how the model works with the aim of making ML models more…

In complex molecular systems, the reaction coordinate (RC) that characterizes transition pathways is essential to understand underlying molecular mechanisms. This review surveys a framework for identifying the RC by applying deep learning…

There has been a significant surge of interest recently around the concept of explainable artificial intelligence (XAI), where the goal is to produce an interpretation for a decision made by a machine learning algorithm. Of particular…

Explainable AI (XAI) is an active research area to interpret a neural network's decision by ensuring transparency and trust in the task-specified learned models. Recently, perturbation-based model analysis has shown better interpretation,…

Explainable Artificial Intelligence (XAI) plays a crucial role in fostering transparency and trust in AI systems, where traditional XAI approaches typically offer one level of abstraction for explanations, often in the form of heatmaps…

Deep neural networks like PhaseNet show high accuracy in detecting microseismic events, but their black-box nature is a concern in critical applications. We apply Explainable Artificial Intelligence (XAI) techniques, such as…

A longstanding challenge surrounding deep learning algorithms is unpacking and understanding how they make their decisions. Explainable Artificial Intelligence (XAI) offers methods to provide explanations of internal functions of algorithms…

Nowadays, deep neural networks are widely used in a variety of fields that have a direct impact on society. Although those models typically show outstanding performance, they have been used for a long time as black boxes. To address this,…

Deep Neural Networks (DNNs) have revolutionized various fields by enabling task automation and reducing human error. However, their internal workings and decision-making processes remain obscure due to their black box nature. Consequently,…

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…

Machine learning (ML) and Deep Learning (DL) methods are being adopted rapidly, especially in computer network security, such as fraud detection, network anomaly detection, intrusion detection, and much more. However, the lack of…

Rapid non-verbal communication of task-based stimuli is a challenge in human-machine teaming, particularly in closed-loop interactions such as driving. To achieve this, we must understand the representations of information for both the…

Explainable artificial intelligence (XAI) enables data-driven understanding of factor associations with response variables, yet communicating XAI outputs to laypersons remains challenging, hindering trust in AI-based predictions. Large…

Artificial Intelligence (AI) has become essential for analyzing complex data and solving highly-challenging tasks. It is being applied across numerous disciplines beyond computer science, including Food Engineering, where there is a growing…

In this study, eXplainable Artificial Intelligence (XAI) methods are applied to analyze flow fields obtained through PIV measurements of an axisymmetric turbulent jet. A convolutional neural network (U-Net) was trained to predict velocity…

This study explores the integration of multiple Explainable AI (XAI) techniques to enhance the interpretability of deep learning models for brain tumour detection. A custom Convolutional Neural Network (CNN) was developed and trained on the…

Identifying reaction coordinates (RCs) is a key to understanding the mechanism of reactions in complex systems. Deep neural network (DNN) and machine learning approaches have become a powerful tool to find the RC. On the other hand, the…

This paper presents an approach integrating explainable artificial intelligence (XAI) techniques with adaptive learning to enhance energy consumption prediction models, with a focus on handling data distribution shifts. Leveraging SHAP…

In this work, we apply and compare two state-of-the-art eXplainability Artificial Intelligence (XAI) methods, the Integrated Gradients (IG) and the SHapley Additive exPlanations (SHAP), that explain the fault diagnosis decisions of a highly…