Abstract--Tree-based ensemble methods consistently outperform single models on tabular classification tasks, yet the conditions under which ensembles provide clear advantages--and prevent overfitting despite using high-variance base learners--are not always well understood by practitioners. We study four real-world classification problems (Breast Cancer diagnosis, Heart Disease prediction, Pima Indians Diabetes, and Credit Card Fraud detection) comparing classical single models against nine ensemble methods using five-seed repeated stratified cross-validation with statistical significance testing. Our results reveal three distinct regimes: (i) On nearly linearly separable data (Breast Cancer), well-regularized linear models achieve 97% accuracy with <2% generalization gaps; ensembles match but do not substantially exceed this performance. We systematically quantify dataset complexity through linearity scores, feature correlation, class separability, and noise estimates, explaining why different data regimes favor different model families. Cross-validated train/test accuracy and generalization-gap plots provide simple visual diagnostics for practitioners to assess when ensemble complexity is warranted. Statistical testing confirms that ensemble gains are significant on nonlinear tasks (p < 0.01) but not on near-linear data (p > 0.15). The study provides actionable guidelines for ensemble model selection in high-stakes tabular applications, with full code and reproducible experiments publicly available. A model that almost perfectly fits its training data can still fail badly on new cases. This gap between training performance and real-world behaviour is the essence of overfitting, and it is particularly problematic in domains such as medical diagnosis and financial fraud detection, where mistakes are costly: missed tumours delay treatment, and undetected fraud translates directly into monetary loss.

Large Language Models (LLMs) are typically aligned with human values using preference data or predefined principles such as helpfulness, honesty, and harmlessness. However, as AI systems progress toward Artificial General Intelligence (AGI) and Artificial Superintelligence (ASI), such value systems may become insufficient. In addition, human feedback-based alignment remains resource-intensive and difficult to scale. While AI-feedback-based self-improving alignment methods have been explored as a scalable alternative, they have largely remained constrained to conventional alignment values. In this work, we explore both a more holistic alignment objective and a scalable, self-improving alignment approach. Aiming to transcend conventional alignment norms, we introduce Collective Agency (CA)--a unified and open-ended alignment value that encourages integrated agentic capabilities. We also propose Dynamic Alignment--an alignment framework that enables an LLM to iteratively align itself. Dynamic Alignment comprises two key components: (1) automated training dataset generation with LLMs, and (2) a self-rewarding mechanism, where the policy model evaluates its own output candidates and assigns rewards for GRPO-based learning. Experimental results demonstrate that our approach successfully aligns the model to CA while preserving general NLP capabilities.

This paper presents the Model Gateway, a management platform for managing machine learning (ML) and scientific computational models in the drug discovery pipeline. The platform supports Large Language Model (LLM) Agents and Generative AI-based tools to perform ML model management tasks in our Machine Learning operations (MLOps) pipelines, such as the dynamic consensus model, a model that aggregates several scientific computational models, registration and management, retrieving model information, asynchronous submission/execution of models, and receiving results once the model complete executions. The platform includes a Model Owner Control Panel, Platform Admin Tools, and Model Gateway API service for interacting with the platform and tracking model execution. The platform achieves a 0% failure rate when testing scaling beyond 10k simultaneous application clients consume models. The Model Gateway is a fundamental part of our model-driven drug discovery pipeline. It has the potential to significantly accelerate the development of new drugs with the maturity of our MLOps infrastructure and the integration of LLM Agents and Generative AI tools.

Large language models display a peculiar form of inconsistency: they "know" the correct answer but fail to act on it. In human philosophy, this tension between global judgment and local impulse is called akrasia, or weakness of will. We propose akrasia as a foundational concept for analyzing inconsistency and goal drift in agentic AI systems. To operationalize it, we introduce a preliminary version of the Akrasia Benchmark, currently a structured set of prompting conditions (Baseline [B], Synonym [S], Temporal [T], and Temptation [X]) that measures when a model's local response contradicts its own prior commitments. The benchmark enables quantitative comparison of "self-control" across model families, decoding strategies, and temptation types. Beyond single-model evaluation, we outline how micro-level akrasia may compound into macro-level instability in multi-agent systems that may be interpreted as "scheming" or deliberate misalignment. By reframing inconsistency as weakness of will, this work connects agentic behavior to classical theories of agency and provides an empirical bridge between philosophy, psychology, and the emerging science of agentic AI.

As large language models (LLMs) transition from research prototypes to production systems, practitioners often need reliable methods to verify that model outputs satisfy required constraints. While sampling-based estimates provide an intuition of model behavior, they offer no sound guarantees. We present BEAVER, the first practical framework for computing deterministic, sound probability bounds on LLM constraint satisfaction. Given any prefix-closed semantic constraint, BEAVER systematically explores the generation space using novel token trie and frontier data structures, maintaining provably sound bounds at every iteration. We formalize the verification problem, prove soundness of our approach, and evaluate BEAVER on correctness verification, privacy verification and secure code generation tasks across multiple state of the art LLMs. BEAVER achieves 6 to 8 times tighter probability bounds and identifies 3 to 4 times more high risk instances compared to baseline methods under identical computational budgets, enabling precise characterization and risk assessment that loose bounds or empirical evaluation cannot provide.

This paper presents the design and implementation of an Extended Reality (XR) platform for immersive, interactive visualization of Electronic Health Records (EHRs). The system extends beyond conventional 2D interfaces by visualizing both structured and unstructured patient data into a shared 3D environment, enabling intuitive exploration and real-time collaboration. The modular infrastructure integrates FHIR-based EHR data with volumetric medical imaging and AI-generated segmentation, ensuring interoperability with modern healthcare systems. The platform's capabilities are demonstrated using synthetic EHR datasets and computed tomography (CT)-derived spine models processed through an AI-powered segmentation pipeline. This work suggests that such integrated XR solutions could form the foundation for next-generation clinical decision-support tools, where advanced data infrastructures are directly accessible in an interactive and spatially rich environment.

Recent advances in large language models (LLMs) have transformed open-domain question answering, yet their effectiveness in music-related reasoning remains limited due to sparse music knowledge in pretraining data. While music information retrieval and computational musicology have explored structured and multimodal understanding, few resources support factual and contextual music question answering (MQA) grounded in artist metadata or historical context. We introduce MusWikiDB, a vector database of 3.2M passages from 144K music-related Wikipedia pages, and ArtistMus, a benchmark of 1,000 questions on 500 diverse artists with metadata such as genre, debut year, and topic. These resources enable systematic evaluation of retrieval-augmented generation (RAG) for MQA. Experiments show that RAG markedly improves factual accuracy; open-source models gain up to +56.8 percentage points (for example, Qwen3 8B improves from 35.0 to 91.8), approaching proprietary model performance. RAG-style fine-tuning further boosts both factual recall and contextual reasoning, improving results on both in-domain and out-of-domain benchmarks. MusWikiDB also yields approximately 6 percentage points higher accuracy and 40% faster retrieval than a general-purpose Wikipedia corpus. We release MusWikiDB and ArtistMus to advance research in music information retrieval and domain-specific question answering, establishing a foundation for retrieval-augmented reasoning in culturally rich domains such as music.

ABSTRACT Existing data-driven methods rely on the extraction of static features from time series to approximate the material removal rate (MRR) of semiconductor manufacturing processes such as chemical mechanical polishing (CMP). However, this leads to a loss of temporal dynamics. Moreover, these methods require a large amount of data for effective training. In this paper, we propose TS-Hint, a Time Series Foundation Model (TSFM) framework, integrated with chain-of-thought reasoning which provides attention hints during training based on attention mechanism data and saliency data. Experimental results demonstrate the effectiveness of our model in limited data settings via few-shot learning and can learn directly from multivariate time series features.

One of the greatest challenges for detecting moving objects in the solar system from wide-field survey data is determining whether a signal indicates a true object or is due to some other source, like noise. Object verification has relied heavily on human eyes, which usually results in significant labor costs. In order to address this limitation and reduce the reliance on manual intervention, we propose a multi-input convolutional neural network integrated with a convolutional block attention module. This method is specifically tailored to enhance the moving object detection system that we have developed and used previously. The current method introduces two innovations. This first one is a multi-input architecture that processes multiple stacked images simultaneously. The second is the incorporation of the convolutional block attention module which enables the model to focus on essential features in both spatial and channel dimensions. These advancements facilitate efficient learning from multiple inputs, leading to more robust detection of moving objects. The performance of the model is evaluated on a dataset consisting of approximately 2,000 observational images. We achieved an accuracy of nearly 99% with AUC (an Area Under the Curve) of >0.99. These metrics indicate that the proposed model achieves excellent classification performance. By adjusting the threshold for object detection, the new model reduces the human workload by more than 99% compared to manual verification.

In enterprise settings, efficiently retrieving relevant information from large and complex knowledge bases is essential for operational productivity and informed decision-making. This research presents a systematic framework for metadata enrichment using large language models (LLMs) to enhance document retrieval in Retrieval-Augmented Generation (RAG) systems. Our approach employs a comprehensive, structured pipeline that dynamically generates meaningful metadata for document segments, substantially improving their semantic representations and retrieval accuracy. Through extensive experiments, we compare three chunking strategies-semantic, recursive, and naive-and evaluate their effectiveness when combined with advanced embedding techniques. The results demonstrate that metadata-enriched approaches consistently outperform content-only baselines, with recursive chunking paired with TF-IDF weighted embeddings yielding an 82.5% precision rate compared to 73.3% for semantic content-only approaches. The naive chunking strategy with prefix-fusion achieved the highest Hit Rate@10 of 0.925. Our evaluation employs cross-encoder reranking for ground truth generation, enabling rigorous assessment via Hit Rate and Metadata Consistency metrics. These findings confirm that metadata enrichment enhances vector clustering quality while reducing retrieval latency, making it a key optimization for RAG systems across knowledge domains. This work offers practical insights for deploying high-performance, scalable document retrieval solutions in enterprise settings, demonstrating that metadata enrichment is a powerful approach for enhancing RAG effectiveness.