Andrew Parnell

Amin Shoari Nejad, Rocío Alaiz-Rodríguez, Gerard D. McCarthy et al.

Environmental monitoring is crucial to our understanding of climate change, biodiversity loss and pollution. The availability of large-scale spatio-temporal data from sources such as sensors and satellites allows us to develop sophisticated models for forecasting and understanding key drivers. However, the data collected from sensors often contain missing values due to faulty equipment or maintenance issues. The missing values rarely occur simultaneously leading to data that are multivariate misaligned sparse time series. We propose two models that are capable of performing multivariate spatio-temporal forecasting while handling missing data naturally without the need for imputation. The first model is a transformer-based model, which we name SERT (Spatio-temporal Encoder Representations from Transformers). The second is a simpler model named SST-ANN (Sparse Spatio-Temporal Artificial Neural Network) which is capable of providing interpretable results. We conduct extensive experiments on two different datasets for multivariate spatio-temporal forecasting and show that our models have competitive or superior performance to those at the state-of-the-art.

Nathan McJames, Andrew Parnell, Yong Chen Goh et al.

Bayesian Causal Forests (BCF) is a causal inference machine learning model based on a highly flexible non-parametric regression and classification tool called Bayesian Additive Regression Trees (BART). Motivated by data from the Trends in International Mathematics and Science Study (TIMSS), which includes data on student achievement in both mathematics and science, we present a multivariate extension of the BCF algorithm. With the help of simulation studies we show that our approach can accurately estimate causal effects for multiple outcomes subject to the same treatment. We also apply our model to Irish data from TIMSS 2019. Our findings reveal the positive effects of having access to a study desk at home (Mathematics ATE 95% CI: [0.20, 11.67]) while also highlighting the negative consequences of students often feeling hungry at school (Mathematics ATE 95% CI: [-11.15, -2.78] , Science ATE 95% CI: [-10.82,-1.72]) or often being absent (Mathematics ATE 95% CI: [-12.47, -1.55]).

Bruna Wundervald, Andrew Parnell, Katarina Domijan

We propose a simple yet powerful extension of Bayesian Additive Regression Trees which we name Hierarchical Embedded BART (HE-BART). The model allows for random effects to be included at the terminal node level of a set of regression trees, making HE-BART a non-parametric alternative to mixed effects models which avoids the need for the user to specify the structure of the random effects in the model, whilst maintaining the prediction and uncertainty calibration properties of standard BART. Using simulated and real-world examples, we demonstrate that this new extension yields superior predictions for many of the standard mixed effects models' example data sets, and yet still provides consistent estimates of the random effect variances. In a future version of this paper, we outline its use in larger, more advanced data sets and structures.

Alan Inglis, Andrew Parnell, Natarajan Subramani et al.

Mycotoxins, toxic secondary metabolites produced by certain fungi, pose significant threats to global food safety and public health. These compounds can contaminate a variety of crops, leading to economic losses and health risks to both humans and animals. Traditional lab analysis methods for mycotoxin detection can be time-consuming and may not always be suitable for large-scale screenings. However, in recent years, machine learning (ML) methods have gained popularity for use in the detection of mycotoxins and in the food safety industry in general, due to their accurate and timely predictions. We provide a systematic review on some of the recent ML applications for detecting/predicting the presence of mycotoxin on a variety of food ingredients, highlighting their advantages, challenges, and potential for future advancements. We address the need for reproducibility and transparency in ML research through open access to data and code. An observation from our findings is the frequent lack of detailed reporting on hyperparameters in many studies as well as a lack of open source code, which raises concerns about the reproducibility and optimisation of the ML models used. The findings reveal that while the majority of studies predominantly utilised neural networks for mycotoxin detection, there was a notable diversity in the types of neural network architectures employed, with convolutional neural networks being the most popular.

Nathan McJames, Ann O'Shea, Andrew Parnell

Modelling growth in student achievement is a significant challenge in the field of education. Understanding how interventions or experiences such as part-time work can influence this growth is also important. Traditional methods like difference-in-differences are effective for estimating causal effects from longitudinal data. Meanwhile, Bayesian non-parametric methods have recently become popular for estimating causal effects from single time point observational studies. However, there remains a scarcity of methods capable of combining the strengths of these two approaches to flexibly estimate heterogeneous causal effects from longitudinal data. Motivated by two waves of data from the High School Longitudinal Study, the NCES' most recent longitudinal study which tracks a representative sample of over 20,000 students in the US, our study introduces a longitudinal extension of Bayesian Causal Forests. This model allows for the flexible identification of both individual growth in mathematical ability and the effects of participation in part-time work. Simulation studies demonstrate the predictive performance and reliable uncertainty quantification of the proposed model. Results reveal the negative impact of part time work for most students, but hint at potential benefits for those students with an initially low sense of school belonging. Clear signs of a widening achievement gap between students with high and low academic achievement are also identified. Potential policy implications are discussed, along with promising areas for future research.

Niamh Mimnagh, Andrew Parnell, Conor McAloon et al.

Bovine Viral Diarrhoea (BVD) has been the focus of a successful eradication programme in Ireland, with the herd-level prevalence declining from 11.3% in 2013 to just 0.2% in 2023. As the country moves toward BVD freedom, the development of predictive models for targeted surveillance becomes increasingly important to mitigate the risk of disease re-emergence. In this study, we evaluate the performance of a range of machine learning algorithms, including binary classification and anomaly detection techniques, for predicting BVD-positive herds using highly imbalanced herd-level data. We conduct an extensive simulation study to assess model performance across varying sample sizes and class imbalance ratios, incorporating resampling, class weighting, and appropriate evaluation metrics (sensitivity, positive predictive value, F1-score and AUC values). Random forests and XGBoost models consistently outperformed other methods, with the random forest model achieving the highest sensitivity and AUC across scenarios, including real-world prediction of 2023 herd status, correctly identifying 219 of 250 positive herds while halving the number of herds that require compared to a blanket-testing strategy.

Mimi Zhang, Andrew Parnell, Dermot Brabazon et al.

Bayesian optimization (BO) is an approach to globally optimizing black-box objective functions that are expensive to evaluate. BO-powered experimental design has found wide application in materials science, chemistry, experimental physics, drug development, etc. This work aims to bring attention to the benefits of applying BO in designing experiments and to provide a BO manual, covering both methodology and software, for the convenience of anyone who wants to apply or learn BO. In particular, we briefly explain the BO technique, review all the applications of BO in additive manufacturing, compare and exemplify the features of different open BO libraries, unlock new potential applications of BO to other types of data (e.g., preferential output). This article is aimed at readers with some understanding of Bayesian methods, but not necessarily with knowledge of additive manufacturing; the software performance overview and implementation instructions are instrumental for any experimental-design practitioner. Moreover, our review in the field of additive manufacturing highlights the current knowledge and technological trends of BO. This article has a supplementary material online.

Bruna Wundervald, Andrew Parnell, Katarina Domijan

We develop a new approach for feature selection via gain penalization in tree-based models. First, we show that previous methods do not perform sufficient regularization and often exhibit sub-optimal out-of-sample performance, especially when correlated features are present. Instead, we develop a new gain penalization idea that exhibits a general local-global regularization for tree-based models. The new method allows for more flexibility in the choice of feature-specific importance weights. We validate our method on both simulated and real data and implement itas an extension of the popular R package ranger.

Yuanzhi Huang, Eamonn Ahearne, Szymon Baron et al.

We examined the use of three conventional anomaly detection methods and assess their potential for on-line tool wear monitoring. Through efficient data processing and transformation of the algorithm proposed here, in a real-time environment, these methods were tested for fast evaluation of cutting tools on CNC machines. The three-dimensional force data streams we used were extracted from a turning experiment of 21 runs for which a tool was run until it generally satisfied an end-of-life criterion. Our real-time anomaly detection algorithm was scored and optimised according to how precisely it can predict the progressive wear of the tool flank. Most of our tool wear predictions were accurate and reliable as illustrated in our off-line simulation results. Particularly when the multivariate analysis was applied, the algorithm we develop was found to be very robust across different scenarios and against parameter changes. It shall be reasonably easy to apply our approach elsewhere for real-time tool wear analytics.