This study explores the deployment of three machine learning (ML) approaches for real-time prediction of glucose, lactate, and ammonium concentrations in cell culture processes, using Raman spectroscopy as input features. The research addresses challenges associated with limited data availability and process variability, providing a comparative analysis of pretrained models, just-in-time learning (JITL), and online learning algorithms. Two industrial case studies are presented to evaluate the impact of varying bioprocess conditions on model performance. The findings highlight the specific conditions under which pretrained models demonstrate superior predictive accuracy and identify scenarios where JITL or online learning approaches are more effective for adaptive process monitoring. This study also highlights the critical importance of updating the deployed models/agents with the latest offline analytical measurements during bioreactor operations to maintain the model performance against the changes in cell growth behaviours and operating conditions throughout the bioreactor run. Additionally, the study confirms the usefulness of a simple mixture-of-experts framework in achieving enhanced accuracy and robustness for real-time predictions of metabolite concentrations based on Raman spectral data. These insights contribute to the development of robust strategies for the efficient deployment of ML models in dynamic and changing biomanufacturing environments.

Radiation Detection Systems (RDSs) are used to measure and detect abnormal levels of radioactive material in the environment. These systems are used in many applications to mitigate threats posed by high levels of radioactive material. However, these systems lack protection against malicious external attacks to modify the data. The novelty of applying Intrusion Detection Systems (IDS) in RDSs is a crucial element in safeguarding these critical infrastructures. While IDSs are widely used in networking environments to safeguard against various attacks, their application in RDSs is novel. A common attack on RDSs is Denial of Service (DoS), where the attacker aims to overwhelm the system, causing malfunctioning RDSs. This paper proposes an efficient Machine Learning (ML)-based IDS to detect anomalies in radiation data, focusing on DoS attacks. This work explores the use of sampling methods to create a simulated DoS attack based on a real radiation dataset, followed by an evaluation of various ML algorithms, including Random Forest, Support Vector Machine (SVM), logistic regression, and Light Gradient-Boosting Machine (LightGBM), to detect DoS attacks on RDSs. LightGBM is emphasized for its superior accuracy and low computational resource consumption, making it particularly suitable for real-time intrusion detection. Additionally, model optimization and TinyML techniques, including feature selection, parallel execution, and random search methods, are used to improve the efficiency of the proposed IDS. Finally, an optimized and efficient LightGBM-based IDS is developed to achieve accurate intrusion detection for RDSs.

This paper presents presents three distinct systems developed for the M-DAIGT shared task on detecting AI generated content in news articles and academic abstracts. The systems includes: (1) A fine-tuned RoBERTa-base classifier, (2) A classical TF-IDF + Support Vector Machine (SVM) classifier , and (3) An Innovative ensemble model named Candace, leveraging probabilistic features extracted from multiple Llama-3.2 models processed by a customTransformer encoder.The RoBERTa-based system emerged as the most performant, achieving near-perfect results on both development and test sets.

Drug discovery is a complex and resource-intensive process, making early prediction of approval outcomes critical for optimizing research investments. While classical machine learning and deep learning methods have shown promise in drug approval prediction, their limited interpretability constraints their impact. Here, we present DrugReasoner, a reasoning-based large language model (LLM) built on the LLaMA architecture and fine-tuned with group relative policy optimization (GRPO) to predict the likelihood of small-molecule approval. DrugReasoner integrates molecular descriptors with comparative reasoning against structurally similar approved and unapproved compounds, generating predictions alongside step-by-step rationales and confidence scores. DrugReasoner achieved robust performance with an AUC of 0.732 and an F1 score of 0.729 on the validation set and 0.725 and 0.718 on the test set, respectively. These results outperformed conventional baselines, including logistic regression, support vector machine, and k-nearest neighbors and had competitive performance relative to XGBoost. On an external independent dataset, DrugReasoner outperformed both baseline and the recently developed ChemAP model, achieving an AUC of 0.728 and an F1-score of 0.774, while maintaining high precision and balanced sensitivity, demonstrating robustness in real-world scenarios. These findings demonstrate that DrugReasoner not only delivers competitive predictive accuracy but also enhances transparency through its reasoning outputs, thereby addressing a key bottleneck in AI-assisted drug discovery. This study highlights the potential of reasoning-augmented LLMs as interpretable and effective tools for pharmaceutical decision-making.

We use a support vector regressor based on a projected quantum kernel method to predict the density structure of 1D fermionic systems of interest in quantum chemistry and quantum matter. The kernel is built on with the observables of a quantum reservoir implementable with interacting Rydberg atoms. Training and test data of the fermionic system are generated using a Density Functional Theory approach. We test the performance of the method for several Hamiltonian parameters, finding a general common behavior of the error as a function of measurement time. At sufficiently large measurement times, we find that the method outperforms the classical linear kernel method and can be competitive with the radial basis function method.

In this paper, we extend the transfer learning classification framework from regression function-based methods to decision rules. We propose a novel methodology for modeling posterior drift through Bayes decision rules. By exploiting the geometric transformation of the Bayes decision boundary, our method reformulates the problem as a low-dimensional empirical risk minimization problem. Under mild regularity conditions, we establish the consistency of our estimators and derive the risk bounds. Moreover, we illustrate the broad applicability of our method by adapting it to the estimation of optimal individualized treatment rules. Extensive simulation studies and analyses of real-world data further demonstrate both superior performance and robustness of our approach.

Human induced pluripotent stem cell-derived cardiomyocytes (iPSC-CMs) are an important resource for the identification of new therapeutic targets and cardioprotective drugs. After differentiation iPSC-CMs show an immature, fetal-like phenotype. Cultivation of iPSC-CMs in lipid-supplemented maturation medium (MM) strongly enhances their structural, metabolic and functional phenotype. Nevertheless, assessing iPSC-CM maturation state remains challenging as most methods are time consuming and go in line with cell damage or loss of the sample. To address this issue, we developed a non-invasive approach for automated classification of iPSC-CM maturity through interpretable artificial intelligence (AI)-based analysis of beat characteristics derived from video-based motion analysis. In a prospective study, we evaluated 230 video recordings of early-state, immature iPSC-CMs on day 21 after differentiation (d21) and more mature iPSC-CMs cultured in MM (d42, MM). For each recording, 10 features were extracted using Maia motion analysis software and entered into a support vector machine (SVM). The hyperparameters of the SVM were optimized in a grid search on 80 % of the data using 5-fold cross-validation. The optimized model achieved an accuracy of 99.5 $\pm$ 1.1 % on a hold-out test set. Shapley Additive Explanations (SHAP) identified displacement, relaxation-rise time and beating duration as the most relevant features for assessing maturity level. Our results suggest the use of non-invasive, optical motion analysis combined with AI-based methods as a tool to assess iPSC-CMs maturity and could be applied before performing functional readouts or drug testing. This may potentially reduce the variability and improve the reproducibility of experimental studies.

The utilization of Machine Learning (ML) in contemporary software systems is extensive and continually expanding. However, its usage is energy-intensive, contributing to increased carbon emissions and demanding significant resources. While numerous studies examine the performance and accuracy of ML, only a limited few focus on its environmental aspects, particularly energy consumption. In addition, despite emerging efforts to compare energy consumption across various programming languages for specific algorithms and tasks, there remains a gap specifically in comparing these languages for ML-based tasks. This paper aims to raise awareness of the energy costs associated with employing different programming languages for ML model training and inference. Through this empirical study, we measure and compare the energy consumption along with run-time performance of five regression and five classification tasks implemented in Python and R, the two most popular programming languages in this context. Our study results reveal a statistically significant difference in costs between the two languages in 95% of the cases examined. Furthermore, our analysis demonstrates that the choice of programming language can influence energy efficiency significantly, up to 99.16% during model training and up to 99.8% during inferences, for a given ML task.

Automatic Speech Recognition has advanced with self-supervised learning, enabling feature extraction directly from raw audio. In Wav2Vec, a CNN first transforms audio into feature vectors before the transformer processes them. This study examines CNN-extracted information for monophthong vowels using the TIMIT corpus. We compare MFCCs, MFCCs with formants, and CNN activations by training SVM classifiers for front-back vowel identification, assessing their classification accuracy to evaluate phonetic representation.

This work presents a machine learning approach based on support vector machines (SVMs) for quantum entanglement detection. Particularly, we focus in bipartite systems of dimensions 3x3, 4x4, and 5x5, where the positive partial transpose criterion (PPT) provides only partial characterization. Using SVMs with quantum-inspired kernels we develop a classification scheme that distinguishes between separable states, PPT-detectable entangled states, and entangled states that evade PPT detection. Our method achieves increasing accuracy with system dimension, reaching 80%, 90%, and nearly 100% for 3x3, 4x4, and 5x5 systems, respectively. Our results show that principal component analysis significantly enhances performance for small training sets. The study reveals important practical considerations regarding purity biases in the generation of data for this problem and examines the challenges of implementing these techniques on near-term quantum hardware. Our results establish machine learning as a powerful complement to traditional entanglement detection methods, particularly for higher-dimensional systems where conventional approaches become inadequate. The findings highlight key directions for future research, including hybrid quantum-classical implementations and improved data generation protocols to overcome current limitations.