Transparency in AI models is essential for promoting human–AI collaboration and ensuring regulatory compliance. However, interpreting these models is a complex process influenced by various methods and datasets. This study presents a comprehensive overview of foundational interpretation techniques, meticulously referencing the original authors and emphasizing their pivotal contributions. Recognizing the seminal work of these pioneers is imperative for contextualizing the evolutionary trajectory of interpretation in the field of AI. Furthermore, this research offers a retrospective analysis of interpretation techniques, critically evaluating their inherent strengths and limitations. We categorize these techniques into model-based, representation-based, post hoc, and hybrid methods, delving into their diverse applications. Furthermore, we analyze publication trends over time to see how the adoption of advanced computational methods within various categories of interpretation techniques has shaped the development of AI interpretability over time. This analysis highlights a notable preference shift towards data-driven approaches in the field. Moreover, we consider crucial factors such as the suitability of these techniques for generating local or global insights and their compatibility with different data types, including images, text, and tabular data. This structured categorization serves as a guide for practitioners navigating the landscape of interpretation techniques in AI. In summary, this review not only synthesizes various interpretation techniques but also acknowledges the contributions of their original authors. By emphasizing the origins of these techniques, we aim to enhance AI model explainability and underscore the importance of recognizing biases, uncertainties, and limitations inherent in the methods and datasets. This approach promotes the ethical and practical use of interpretation insights, empowering AI practitioners, researchers, and professionals to make informed decisions when selecting techniques for responsible AI implementation in real-world scenarios.
The self-organizing map (SOM) is a nonlinear machine learning algorithm that is particularly well suited for visualizing and analyzing high-dimensional, hyperspectral time-of-flight secondary ion mass spectrometry (ToF-SIMS) imaging data. Previously, we compared the capabilities of the SOM with more traditional linear techniques using ToF-SIMS imaging data. Although SOMs perform well with minimal data preprocessing and negligible hyperparameter optimization, it is important to understand how different data preprocessing methods and hyperparameter settings influence the performance of SOMs. While these investigations have been reported outside of the ToF-SIMS field, no such study has been reported for hyperspectral MSI data. To address this, we used two labeled ToF-SIMS imaging datasets, one of which was a polymer microarray dataset, while the other was semisynthetic hyperspectral data. The latter was generated using a novel algorithm that we describe here. A grid-search was used to evaluate which data preprocessing methods and SOM hyperparameters had the largest impact on the performance of the SOM. This was assessed using multiple linear regression, whereby performance metrics were regressed onto each variable defining the preprocessing-hyperparameter space. We found that preprocessing was generally more important than hyperparameter selection. We also found statistically significant interactions between several parameters studied, suggesting a complex interplay between preprocessing and hyperparameter selection. Importantly, we identified interesting trends, both dataset specific and dataset agnostic, which we describe and discuss in detail.
5 January 2024 in Reaction Chemistry & Engineering
Machine-learning assisted optimisation of a continuous photodegradation reaction, using a TiO2 coated catalytic static mixer successfully accounting for catalyst degradation.
Certified disposable respirators afford important protection from hazardous aerosols but lose performance as they are worn. This study examines the effect of wear time on filtration efficiency. Disposable respirators were worn by CSIRO staff over a period of 4 weeks in early 2020. Participants wore the respirator masks for given times up to eight hours whilst working in laboratory/office environments. At that time COVID-19 precautions required staff to wear surgical (or other) masks and increase use of hand sanitizer from dispenser stations. Results obtained from a test group of ten individuals without health preconditions show an increasing number of masks failing with wear time, while the remainder continue to perform nearly unaffected for up to 8 h. Some masks were found to retain filtration performance better than others, possibly due to the type of challenge they were subjected to by the wearer. However, the rate and extent of decay are expected to differ between environments since there are many contributing factors and properties of the aerosol challenge cannot be controlled in a live trial. Penetration and variability increased during wear; the longer the wear time, the more deleterious to particle removal, particularly after approximately 2 h of wear. This behavior is captured in a descriptive statistical model based on results from a trial with this test group. The effectiveness of the masks in preventing the penetration of KCl particles was determined before and after wearing, with the analysis focusing on the most penetrating particles in a size range of 0.3–0.5 µm diameter where respirator masks are most vulnerable. The basic elements of the study, including the approach to filter testing and sample sanitization, are broadly applicable. Conclusions also have applicability to typical commercially available single-use respirator masks manufactured from melt blown polypropylene as they are reliant on the same physical principles for particle capture and electrostatic enhancement was comparable for the particle size range used for detection.