Performance Analysis
A Multicollinearity-Aware Signal-Processing Framework for Cross-$β$ Identification via X-ray Scattering of Alzheimer's Tissue
Bashit, Abdullah Al, Nepal, Prakash, Makowski, Lee
X-ray scattering measurements of in situ human brain tissue encode structural signatures of pathological cross-$β$ inclusions, yet systematic exploitation of these data for automated detection remains challenging due to substrate contamination, strong inter-feature correlations, and limited sample sizes. This work develops a three-stage classification framework for identifying cross-$β$ structural inclusions-a hallmark of Alzheimer's disease-in X-ray scattering profiles of post-mortem human brain. Stage 1 employs a Bayes-optimal classifier to separate mica substrate from tissue regions on the basis of their distinct scattering signatures. Stage 2 introduces a multicollinearityaware, class-conditional correlation pruning scheme with formal guarantees on the induced Bayes risk and approximation error, thereby reducing redundancy while retaining class-discriminative information. Stage 3 trains a compact neural network on the pruned feature set to detect the presence or absence of cross-$β$ fibrillar ordering. The top-performing model, optimized with a composite loss combining Focal and Dice objectives, attains a test F1-score of 84.30% using 11 of 211 candidate features and 174 trainable parameters. The overall framework yields an interpretable, theory-grounded strategy for data-limited classification problems involving correlated, high-dimensional experimental measurements, exemplified here by X-ray scattering profiles of neurodegenerative tissue.
CEDL: Centre-Enhanced Discriminative Learning for Anomaly Detection
Darban, Zahra Zamanzadeh, Wang, Qizhou, Aggarwal, Charu C., Webb, Geoffrey I., Abbasnejad, Ehsan, Salehi, Mahsa
Supervised anomaly detection methods perform well in identifying known anomalies that are well represented in the training set. However, they often struggle to generalise beyond the training distribution due to decision boundaries that lack a clear definition of normality. Existing approaches typically address this by regularising the representation space during training, leading to separate optimisation in latent and label spaces. The learned normality is therefore not directly utilised at inference, and their anomaly scores often fall within arbitrary ranges that require explicit mapping or calibration for probabilistic interpretation. To achieve unified learning of geometric normality and label discrimination, we propose Centre-Enhanced Discriminative Learning (CEDL), a novel supervised anomaly detection framework that embeds geometric normality directly into the discriminative objective. CEDL reparameterises the conventional sigmoid-derived prediction logit through a centre-based radial distance function, unifying geometric and discriminative learning in a single end-to-end formulation. This design enables interpretable, geometry-aware anomaly scoring without post-hoc thresholding or reference calibration. Extensive experiments on tabular, time-series, and image data demonstrate that CEDL achieves competitive and balanced performance across diverse real-world anomaly detection tasks, validating its effectiveness and broad applicability.
Evaluation of Multi- and Single-objective Learning Algorithms for Imbalanced Data
Wojciechowski, Szymon, Woźniak, Michał
Many machine learning tasks aim to find models that work well not for a single, but for a group of criteria, often opposing ones. One such example is imbalanced data classification, where, on the one hand, we want to achieve the best possible classification quality for data from the minority class without degrading the classification quality of the majority class. One solution is to propose an aggregate learning criterion and reduce the multi-objective learning task to a single-criteria optimization problem. Unfortunately, such an approach is characterized by ambiguity of interpretation since the value of the aggregated criterion does not indicate the value of the component criteria. Hence, there are more and more proposals for algorithms based on multi-objective optimization (MOO), which can simultaneously optimize multiple criteria. However, such an approach results in a set of multiple non-dominated solutions (Pareto front). The selection of a single solution from the Pareto front is a challenge itself, and much attention is paid to the issue of how to select it considering user preferences, as well as how to compare solutions returned by different MOO algorithms among themselves. Thus, a significant gap has been identified in the classifier evaluation methodology, i.e., how to reliably compare methods returning single solutions with algorithms returning solutions in the form of Pareto fronts. To fill the aforementioned gap, this article proposes a new, reliable way of evaluating algorithms based on multi-objective algorithms with methods that return single solutions while pointing out solutions from a Pareto front tailored to the user's preferences. This work focuses only on algorithm comparison, not their learning. The algorithms selected for this study are illustrative to help understand the proposed approach.
AI-Enhanced IoT Systems for Predictive Maintenance and Affordability Optimization in Smart Microgrids: A Digital Twin Approach
Kushal, Koushik Ahmed, Gueniat, Florimond
This study presents an AI enhanced IoT framework for predictive maintenance and affordability optimization in smart microgrids using a Digital Twin modeling approach. The proposed system integrates real time sensor data, machine learning based fault prediction, and cost aware operational analytics to improve reliability and energy efficiency in distributed microgrid environments. By synchronizing physical microgrid components with a virtual Digital Twin, the framework enables early detection of component degradation, dynamic load management, and optimized maintenance scheduling. Experimental evaluations demonstrate improved predictive accuracy, reduced operational downtime, and measurable cost savings compared to baseline microgrid management methods. The findings highlight the potential of Digital Twin driven IoT architectures as a scalable solution for next generation intelligent and affordable energy systems.
Rapid Machine Learning-Driven Detection of Pesticides and Dyes Using Raman Spectroscopy
Binh, Quach Thi Thai, Phuoc, Thuan, Hai, Xuan, Phan, Thang Bach, Thu, Vu Thi Hanh, Hung, Nguyen Tuan
The extensive use of pesticides and synthetic dyes poses critical threats to food safety, human health, and environmental sustainability, necessitating rapid and reliable detection methods. Raman spectroscopy offers molecularly specific fingerprints but suffers from spectral noise, fluorescence background, and band overlap, limiting its real-world applicability. Here, we propose a deep learning framework based on ResNet-18 feature extraction, combined with advanced classifiers, including XGBoost, SVM, and their hybrid integration, to detect pesticides and dyes from Raman spectroscopy, called MLRaman. The MLRaman with the CNN-XGBoost model achieved a predictive accuracy of 97.4% and a perfect AUC of 1.0, while it with the CNN-SVM model provided competitive results with robust class-wise discrimination. Dimensionality reduction analyses (PCA, t-SNE, UMAP) confirmed the separability of Raman embeddings across 10 analytes, including 7 pesticides and 3 dyes. Finally, we developed a user-friendly Streamlit application for real-time prediction, which successfully identified unseen Raman spectra from our independent experiments and also literature sources, underscoring strong generalization capacity. This study establishes a scalable, practical MLRaman model for multi-residue contaminant monitoring, with significant potential for deployment in food safety and environmental surveillance.
FairGSE: Fairness-Aware Graph Neural Network without High False Positive Rates
Ye, Zhenqiang, Lu, Jinjie, Gu, Tianlong, Hao, Fengrui, Wang, Xuemin
Graph neural networks (GNNs) have emerged as the mainstream paradigm for graph representation learning due to their effective message aggregation. However, this advantage also amplifies biases inherent in graph topology, raising fairness concerns. Existing fairness-aware GNNs provide satisfactory performance on fairness metrics such as Statistical Parity and Equal Opportunity while maintaining acceptable accuracy trade-offs. Unfortunately, we observe that this pursuit of fairness metrics neglects the GNN's ability to predict negative labels, which renders their predictions with extremely high False Positive Rates (FPR), resulting in negative effects in high-risk scenarios. To this end, we advocate that classification performance should be carefully calibrated while improving fairness, rather than simply constraining accuracy loss. Furthermore, we propose Fair GNN via Structural Entropy (\textbf{FairGSE}), a novel framework that maximizes two-dimensional structural entropy (2D-SE) to improve fairness without neglecting false positives. Experiments on several real-world datasets show FairGSE reduces FPR by 39\% vs. state-of-the-art fairness-aware GNNs, with comparable fairness improvement.
Informed Bootstrap Augmentation Improves EEG Decoding
Jeong, Woojae, Cui, Wenhui, Avramidis, Kleanthis, Medani, Takfarinas, Narayanan, Shrikanth, Leahy, Richard
Electroencephalography (EEG) offers detailed access to neural dynamics but remains constrained by noise and trial-by-trial variability, limiting decoding performance in data-restricted or complex paradigms. Data augmentation is often employed to enhance feature representations, yet conventional uniform averaging overlooks differences in trial informativeness and can degrade representational quality. We introduce a weighted bootstrapping approach that prioritizes more reliable trials to generate higher-quality augmented samples. In a Sentence Evaluation paradigm, weights were computed from relative ERP differences and applied during probabilistic sampling and averaging. Across conditions, weighted bootstrapping improved decoding accuracy relative to unweighted (from 68.35% to 71.25% at best), demonstrating that emphasizing reliable trials strengthens representational quality. The results demonstrate that reliability-based augmentation yields more robust and discriminative EEG representations. The code is publicly available at https://github.com/lyricists/NeuroBootstrap.
Adaptive Diagnostic Reasoning Framework for Pathology with Multimodal Large Language Models
Hong, Yunqi, Kao, Johnson, Edwards, Liam, Liu, Nein-Tzu, Huang, Chung-Yen, Oliveira-Kowaleski, Alex, Hsieh, Cho-Jui, Lin, Neil Y. C.
AI tools in pathology have improved screening throughput, standardized quantification, and revealed prognostic patterns that inform treatment. However, adoption remains limited because most systems still lack the human-readable reasoning needed to audit decisions and prevent errors. We present RECAP-PATH, an interpretable framework that establishes a self-learning paradigm, shifting off-the-shelf multimodal large language models from passive pattern recognition to evidence-linked diagnostic reasoning. At its core is a two-phase learning process that autonomously derives diagnostic criteria: diversification expands pathology-style explanations, while optimization refines them for accuracy. This self-learning approach requires only small labeled sets and no white-box access or weight updates to generate cancer diagnoses. Evaluated on breast and prostate datasets, RECAP-PATH produced rationales aligned with expert assessment and delivered substantial gains in diagnostic accuracy over baselines. By uniting visual understanding with reasoning, RECAP-PATH provides clinically trustworthy AI and demonstrates a generalizable path toward evidence-linked interpretation.
End to End AI System for Surgical Gesture Sequence Recognition and Clinical Outcome Prediction
Li, Xi, Matsumoto, Nicholas, Pasupulety, Ujjwal, Deo, Atharva, Yang, Cherine, Moran, Jay, Hernandez, Miguel E., Wager, Peter, Lin, Jasmine, Kim, Jeanine, Goh, Alvin C., Wagner, Christian, Sonn, Geoffrey A., Hung, Andrew J.
Fine-grained analysis of intraoperative behavior and its impact on patient outcomes remain a longstanding challenge. We present Frame-to-Outcome (F2O), an end-to-end system that translates tissue dissection videos into gesture sequences and uncovers patterns associated with postoperative outcomes. Leveraging transformer-based spatial and temporal modeling and frame-wise classification, F2O robustly detects consecutive short (~2 seconds) gestures in the nerve-sparing step of robot-assisted radical prostatectomy (AUC: 0.80 frame-level; 0.81 video-level). F2O-derived features (gesture frequency, duration, and transitions) predicted postoperative outcomes with accuracy comparable to human annotations (0.79 vs. 0.75; overlapping 95% CI). Across 25 shared features, effect size directions were concordant with small differences (~ 0.07), and strong correlation (r = 0.96, p < 1e-14). F2O also captured key patterns linked to erectile function recovery, including prolonged tissue peeling and reduced energy use. By enabling automatic interpretable assessment, F2O establishes a foundation for data-driven surgical feedback and prospective clinical decision support.
Federated Learning for Pediatric Pneumonia Detection: Enabling Collaborative Diagnosis Without Sharing Patient Data
Jimenez-Gutierrez, Daniel M., Zuazua, Enrique, Del Rio, Joaquin, Sliusarenko, Oleksii, Uribe-Etxebarria, Xabi
Early and accurate pneumonia detection from chest X-rays (CXRs) is clinically critical to expedite treatment and isolation, reduce complications, and curb unnecessary antibiotic use. Although artificial intelligence (AI) substantially improves CXR-based detection, development is hindered by globally distributed data, high inter-hospital variability, and strict privacy regulations (e.g., HIPAA, GDPR) that make centralization impractical. These constraints are compounded by heterogeneous imaging protocols, uneven data availability, and the costs of transferring large medical images across geographically dispersed sites. In this paper, we evaluate Federated Learning (FL) using the Sherpa.ai FL platform, enabling multiple hospitals (nodes) to collaboratively train a CXR classifier for pneumonia while keeping data in place and private. Using the Pediatric Pneumonia Chest X-ray dataset, we simulate cross-hospital collaboration with non-independent and non-identically distributed (non-IID) data, reproducing real-world variability across institutions and jurisdictions. Our experiments demonstrate that collaborative and privacy-preserving training across multiple hospitals via FL led to a dramatic performance improvement achieving 0.900 Accuracy and 0.966 ROC-AUC, corresponding to 47.5% and 50.0% gains over single-hospital models (0.610; 0.644), without transferring any patient CXR. These results indicate that FL delivers high-performing, generalizable, secure and private pneumonia detection across healthcare networks, with data kept local. This is especially relevant for rare diseases, where FL enables secure multi-institutional collaboration without data movement, representing a breakthrough for accelerating diagnosis and treatment development in low-data domains.