Accurately predicting blood glucose (BG) levels of ICU patients is critical, as both hypoglycemia (BG < 70 mg/dL) and hyperglycemia (BG > 180 mg/dL) are associated with increased morbidity and mortality. This study presents a proof-of-concept machine learning framework, the Multi-source Irregular Time-Series Transformer (MITST), designed to predict BG levels in ICU patients. In contrast to existing methods that rely heavily on manual feature engineering or utilize limited Electronic Health Record (EHR) data sources, MITST integrates diverse clinical data--including laboratory results, medications, and vital signs without predefined aggregation. The model leverages a hierarchical Transformer architecture, designed to capture interactions among features within individual timestamps, temporal dependencies across different timestamps, and semantic relationships across multiple data sources. Evaluated using the extensive eICU database (200,859 ICU stays across 208 hospitals), MITST achieves a statistically significant ( p < 0.001 ) average improvement of 1.7 percentage points (pp) in AUROC and 1.8 pp in AUPRC over a state-of-the-art random forest baseline. Crucially, for hypoglycemia--a rare but life-threatening condition--MITST increases sensitivity by 7.2 pp, potentially enabling hundreds of earlier interventions across ICU populations. The flexible architecture of MITST allows seamless integration of new data sources without retraining the entire model, enhancing its adaptability for clinical decision support. While this study focuses on predicting BG levels, we also demonstrate MITST's ability to generalize to a distinct clinical task (in-hospital mortality prediction), highlighting its potential for broader applicability in ICU settings. MITST thus offers a robust and extensible solution for analyzing complex, multi-source, irregular time-series data.
In today's data-driven world, the ability to extract meaningful information from data is becoming essential for businesses, organizations and researchers alike. For that purpose, a wide range of tools and systems exist addressing data-related tasks, from data integration, preprocessing and modeling, to the interpretation and evaluation of the results. As data continues to grow in volume, variety, and complexity, there is an increasing need for advanced but user-friendly tools, such as intelligent discovery assistants (IDAs) or automated machine learning (AutoML) systems, that facilitate the user's interaction with the data. This enables non-expert users, such as citizen data scientists, to leverage powerful data analytics techniques effectively. The assistance offered by IDAs or AutoML tools should not be guided only by the analytical problem's data but should also be tailored to each individual user. To this end, this work explores the usage of Knowledge Graphs (KG) as a basic framework for capturing in a human-centered manner complex analytics workflows, by storing information not only about the workflow's components, datasets and algorithms but also about the users, their intents and their feedback, among others. The data stored in the generated KG can then be exploited to provide assistance (e.g., recommendations) to the users interacting with these systems. To accomplish this objective, two methods are explored in this work. Initially, the usage of query templates to extract relevant information from the KG is studied. However, upon identifying its main limitations, the usage of link prediction with knowledge graph embeddings is explored, which enhances flexibility and allows leveraging the entire structure and components of the graph. The experiments show that the proposed method is able to capture the graph's structure and to produce sensible suggestions.
The emergence of models like GPTs, Claude, LLaMA, and Qwen has reshaped AI applications, presenting vast new opportunities across industries. Yet, the integration of tabular data remains notably underdeveloped, despite its foundational role in numerous real-world domains. This gap is critical for three main reasons. First, database or data warehouse data integration is essential for advanced applications; second, the vast and largely untapped resource of tabular data offers immense potential for analysis; and third, the business intelligence domain specifically demands adaptable, precise solutions that many current LLMs may struggle to provide. In response, we introduce TableGPT2, a model rigorously pre-trained and fine-tuned with over 593.8K tables and 2.36M high-quality query-table-output tuples, a scale of table-related data unprecedented in prior research. This extensive training enables TableGPT2 to excel in table-centric tasks while maintaining strong general language and coding abilities. One of TableGPT2's key innovations is its novel table encoder, specifically designed to capture schema-level and cell-level information. This encoder strengthens the model's ability to handle ambiguous queries, missing column names, and irregular tables commonly encountered in real-world applications. Similar to visual language models, this pioneering approach integrates with the decoder to form a robust large multimodal model. We believe the results are compelling: over 23 benchmarking metrics, TableGPT2 achieves an average performance improvement of 35.20% in the 7B model and 49.32% in the 72B model over prior benchmark-neutral LLMs, with robust general-purpose capabilities intact.
Knowledge graphs (KGs) are increasingly utilized for data integration, representation, and visualization. While KG population is critical, it is often costly, especially when data must be extracted from unstructured text in natural language, which presents challenges, such as ambiguity and complex interpretations. Large Language Models (LLMs) offer promising capabilities for such tasks, excelling in natural language understanding and content generation. However, their tendency to ``hallucinate'' can produce inaccurate outputs. Despite these limitations, LLMs offer rapid and scalable processing of natural language data, and with prompt engineering and fine-tuning, they can approximate human-level performance in extracting and structuring data for KGs. This study investigates LLM effectiveness for the KG population, focusing on the Enslaved.org Hub Ontology. In this paper, we report that compared to the ground truth, LLM's can extract ~90% of triples, when provided a modular ontology as guidance in the prompts.
This paper introduces a microservices architecture for the purpose of enhancing the flexibility and performance of an airline reservation system. The architectural design incorporates Redis cache technologies, two different messaging systems (Kafka and RabbitMQ), two types of storages (MongoDB, and PostgreSQL). It also introduces authorization techniques, including secure communication through OAuth2 and JWT which is essential with the management of high-demand travel services. According to selected indicators, the architecture provides an impressive level of data consistency at 99.5% and a latency of data propagation of less than 75 ms allowing rapid and reliable intercommunication between microservices. A system throughput of 1050 events per second was achieved so that the acceptability level was maintained even during peak time. Redis caching reduced a 92% cache hit ratio on the database thereby lowering the burden on the database and increasing the speed of response. Further improvement of the systems scalability was done through the use of Docker and Kubernetes which enabled services to be expanded horizontally to cope with the changes in demand. The error rates were very low, at 0.2% further enhancing the efficiency of the system in handling real-time data integration. This approach is suggested to meet the specific needs of the airline reservation system. It is secure, fast, scalable, all serving to improve the user experience as well as the efficiency of operations. The low latency and high data integration levels and prevaiing efficient usage of the resources demonstrates the architecture ability to offer continued support in the ever growing high demand situations.
Schema matching -- the task of finding matches between attributes across disparate data sources with different tables and hierarchies -- is critical for creating interoperable machine learning (ML)-ready data. Addressing this fundamental data-centric problem has wide implications, especially in domains like healthcare, finance and e-commerce -- but also has the potential to benefit ML models more generally, by increasing the data available for ML model training. However, schema matching is a challenging ML task due to structural/hierarchical and semantic heterogeneity between different schemas. Previous ML approaches to automate schema matching have either required significant labeled data for model training, which is often unrealistic or suffer from poor zero-shot performance. To this end, we propose Matchmaker - a compositional language model program for schema matching, comprised of candidate generation, refinement and confidence scoring. Matchmaker also self-improves in a zero-shot manner without the need for labeled demonstrations via a novel optimization approach, which constructs synthetic in-context demonstrations to guide the language model's reasoning process. Empirically, we demonstrate on real-world medical schema matching benchmarks that Matchmaker outperforms previous ML-based approaches, highlighting its potential to accelerate data integration and interoperability of ML-ready data.
Data from individual observations can originate from various sources or modalities but are often intrinsically linked. Multimodal data integration can enrich information content compared to single-source data. Manifold alignment is a form of data integration that seeks a shared, underlying low-dimensional representation of multiple data sources that emphasizes similarities between alternative representations of the same entities. Semi-supervised manifold alignment relies on partially known correspondences between domains, either through shared features or through other known associations. In this paper, we introduce two semi-supervised manifold alignment methods. The first method, Shortest Paths on the Union of Domains (SPUD), forms a unified graph structure using known correspondences to establish graph edges. By learning inter-domain geodesic distances, SPUD creates a global, multi-domain structure. The second method, MASH (Manifold Alignment via Stochastic Hopping), learns local geometry within each domain and forms a joint diffusion operator using known correspondences to iteratively learn new inter-domain correspondences through a random-walk approach. Through the diffusion process, MASH forms a coupling matrix that links heterogeneous domains into a unified structure. We compare SPUD and MASH with existing semi-supervised manifold alignment methods and show that they outperform competing methods in aligning true correspondences and cross-domain classification. In addition, we show how these methods can be applied to transfer label information between domains.
Document parsing is essential for converting unstructured and semi-structured documents such as contracts, academic papers, and invoices into structured, machine-readable data. Document parsing reliable structured data from unstructured inputs, providing huge convenience for numerous applications. Especially with recent achievements in Large Language Models, document parsing plays an indispensable role in both knowledge base construction and training data generation. This survey presents a comprehensive review of the current state of document parsing, covering key methodologies, from modular pipeline systems to end-to-end models driven by large vision-language models. Core components such as layout detection, content extraction (including text, tables, and mathematical expressions), and multi-modal data integration are examined in detail. Additionally, this paper discusses the challenges faced by modular document parsing systems and vision-language models in handling complex layouts, integrating multiple modules, and recognizing high-density text. It outlines future research directions and emphasizes the importance of developing larger and more diverse datasets.
Effective monitoring of freight transportation is essential for advancing sustainable, low-carbon economies. Traditional methods relying on single-modal data and discrete simulations fall short in optimizing intermodal systems holistically. These systems involve interconnected processes that affect shipping time, costs, emissions, and socio-economic factors. Developing digital twins for real-time awareness, predictive analytics, and urban logistics optimization requires extensive efforts in knowledge discovery, data integration, and multi-domain simulation. Recent advancements in generative AI offer new opportunities to streamline digital twin development by automating knowledge discovery and data integration, generating innovative simulation and optimization solutions. These models extend digital twins' capabilities by promoting autonomous workflows for data engineering, analytics, and software development. This paper proposes an innovative paradigm that leverages generative AI to enhance digital twins for urban research and operations. Using freight decarbonization as a case study, we propose a conceptual framework employing transformer-based language models to enhance an urban digital twin through foundation models. We share preliminary results and our vision for more intelligent, autonomous, and general-purpose digital twins for optimizing integrated freight systems from multimodal to synchromodal paradigms.
metasnf is an R package that enables users to apply meta clustering, a method for efficiently searching a broad space of cluster solutions by clustering the solutions themselves, to clustering workflows based on similarity network fusion (SNF). SNF is a multi-modal data integration algorithm commonly used for biomedical subtype discovery. The package also contains functions to assist with cluster visualization, characterization, and validation. This package can help researchers identify SNF-derived cluster solutions that are guided by context-specific utility over context-agnostic measures of quality.
Geospatial Knowledge Graphs (GeoKGs) have become integral to the growing field of Geospatial Artificial Intelligence. Initiatives like the U.S. National Science Foundation's Open Knowledge Network program aim to create an ecosystem of nation-scale, cross-disciplinary GeoKGs that provide AI-ready geospatial data aligned with FAIR principles. However, building this infrastructure presents key challenges, including 1) managing large volumes of data, 2) the computational complexity of discovering topological relations via SPARQL, and 3) conflating multi-scale raster and vector data. Discrete Global Grid Systems (DGGS) help tackle these issues by offering efficient data integration and representation strategies. The KnowWhereGraph utilizes Google's S2 Geometry -- a DGGS framework -- to enable efficient multi-source data processing, qualitative spatial querying, and cross-graph integration. This paper outlines the implementation of S2 within KnowWhereGraph, emphasizing its role in topologically enriching and semantically compressing data. Ultimately, this work demonstrates the potential of DGGS frameworks, particularly S2, for building scalable GeoKGs.
This review examines current and potential applications of DTs in healthcare, focusing on the integration of multi-omics data using multilayer network approaches in cancer research. We discuss methodologies, tools and platforms commonly used for this integration, while highlighting case studies, challenges, and research gaps. Finally, we advocate the need for incorporating diverse data types to produce more effective DTs for personalization of cancer treatments and in silico clinical trials.
Schema matching (SM) and entity matching (EM) tasks are crucial for data integration. While large language models (LLMs) have shown promising results in these tasks, they suffer from hallucinations and confusion about task instructions. This study presents the Knowledge-Compliant Matching Framework (KcMF), an LLM-based approach that addresses these issues without the need for domain-specific fine-tuning. KcMF employs a once-and-for-all pseudo-code-based task decomposition strategy to adopt natural language statements that guide LLM reasoning and reduce confusion across various task types. We also propose two mechanisms, Dataset as Knowledge (DaK) and Example as Knowledge (EaK), to build domain knowledge sets when unstructured domain knowledge is lacking. Moreover, we introduce a result-ensemble strategy to leverage multiple knowledge sources and suppress badly formatted outputs. Extensive evaluations confirm that KcMF clearly enhances five LLM backbones in both SM and EM tasks while outperforming the non-LLM competitors by an average F1-score of 17.93%.
We introduce GENomic Encoding REpresentation with Language Model (GENEREL), a framework designed to bridge genetic and biomedical knowledge bases. What sets GENEREL apart is its ability to fine-tune language models to infuse biological knowledge behind clinical concepts such as diseases and medications. This fine-tuning enables the model to capture complex biomedical relationships more effectively, enriching the understanding of how genomic data connects to clinical outcomes. By constructing a unified embedding space for biomedical concepts and a wide range of common SNPs from sources such as patient-level data, biomedical knowledge graphs, and GWAS summaries, GENEREL aligns the embeddings of SNPs and clinical concepts through multi-task contrastive learning. This allows the model to adapt to diverse natural language representations of biomedical concepts while bypassing the limitations of traditional code mapping systems across different data sources. Our experiments demonstrate GENEREL's ability to effectively capture the nuanced relationships between SNPs and clinical concepts. GENEREL also emerges to discern the degree of relatedness, potentially allowing for a more refined identification of concepts. This pioneering approach in constructing a unified embedding system for both SNPs and biomedical concepts enhances the potential for data integration and discovery in biomedical research.
Understanding and designing biomolecules, such as proteins and small molecules, is central to advancing drug discovery, synthetic biology, and enzyme engineering. Recent breakthroughs in Artificial Intelligence (AI) have revolutionized biomolecular research, achieving remarkable accuracy in biomolecular prediction and design. However, a critical gap remains between AI's computational power and researchers' intuition, using natural language to align molecular complexity with human intentions. Large Language Models (LLMs) have shown potential to interpret human intentions, yet their application to biomolecular research remains nascent due to challenges including specialized knowledge requirements, multimodal data integration, and semantic alignment between natural language and biomolecules. To address these limitations, we present InstructBioMol, a novel LLM designed to bridge natural language and biomolecules through a comprehensive any-to-any alignment of natural language, molecules, and proteins. This model can integrate multimodal biomolecules as input, and enable researchers to articulate design goals in natural language, providing biomolecular outputs that meet precise biological needs. Experimental results demonstrate InstructBioMol can understand and design biomolecules following human instructions. Notably, it can generate drug molecules with a 10% improvement in binding affinity and design enzymes that achieve an ESP Score of 70.4, making it the only method to surpass the enzyme-substrate interaction threshold of 60.0 recommended by the ESP developer. This highlights its potential to transform real-world biomolecular research.
Multi-omics data is increasingly being utilized to advance computational methods for cancer classification. However, multi-omics data integration poses significant challenges due to the high dimensionality, data complexity, and distinct characteristics of various omics types. This study addresses these challenges and evaluates three graph neural network architectures for multi-omics (MO) integration based on graph-convolutional networks (GCN), graph-attention networks (GAT), and graph-transformer networks (GTN) for classifying 31 cancer types and normal tissues. To address the high-dimensionality of multi-omics data, we employed LASSO (Least Absolute Shrinkage and Selection Operator) regression for feature selection, leading to the creation of LASSO-MOGCN, LASSO-MOGAT, and LASSO-MOTGN models. Graph structures for the networks were constructed using gene correlation matrices and protein-protein interaction networks for multi-omics integration of messenger-RNA, micro-RNA, and DNA methylation data. Such data integration enables the networks to dynamically focus on important relationships between biological entities, improving both model performance and interpretability. Among the models, LASSO-MOGAT with a correlation-based graph structure achieved state-of-the-art accuracy (95.9%) and outperformed the LASSO-MOGCN and LASSO-MOTGN models in terms of precision, recall, and F1-score. Our findings demonstrate that integrating multi-omics data in graph-based architectures enhances cancer classification performance by uncovering distinct molecular patterns that contribute to a better understanding of cancer biology and potential biomarkers for disease progression.
Objective: To improve prediction of Chronic Kidney Disease (CKD) progression to End Stage Renal Disease (ESRD) using machine learning (ML) and deep learning (DL) models applied to an integrated clinical and claims dataset of varying observation windows, supported by explainable AI (XAI) to enhance interpretability and reduce bias. Materials and Methods: We utilized data about 10,326 CKD patients, combining their clinical and claims information from 2009 to 2018. Following data preprocessing, cohort identification, and feature engineering, we evaluated multiple statistical, ML and DL models using data extracted from five distinct observation windows. Feature importance and Shapley value analysis were employed to understand key predictors. Models were tested for robustness, clinical relevance, misclassification errors and bias issues. Results: Integrated data models outperformed those using single data sources, with the Long Short-Term Memory (LSTM) model achieving the highest AUC (0.93) and F1 score (0.65). A 24-month observation window was identified as optimal for balancing early detection and prediction accuracy. The 2021 eGFR equation improved prediction accuracy and reduced racial bias, notably for African American patients. Discussion: Improved ESRD prediction accuracy, results interpretability and bias mitigation strategies presented in this study have the potential to significantly enhance CKD and ESRD management, support targeted early interventions and reduce healthcare disparities. Conclusion: This study presents a robust framework for predicting ESRD outcomes in CKD patients, improving clinical decision-making and patient care through multi-sourced, integrated data and AI/ML methods. Future research will expand data integration and explore the application of this framework to other chronic diseases.
Digital Twins technology is revolutionizing decision-making in scientific research by integrating models and simulations with real-time data. Unlike traditional Structural Health Monitoring methods, which rely on computationally intensive Digital Image Correlation and have limitations in real-time data integration, this research proposes a novel approach using Artificial Intelligence. Specifically, Convolutional Neural Networks are employed to analyze structural behaviors in real-time by correlating Digital Image Correlation speckle pattern images with deformation fields. Initially focusing on two-dimensional speckle patterns, the research extends to three-dimensional applications using stereo-paired images for comprehensive deformation analysis. This method overcomes computational challenges by utilizing a mix of synthetically generated and authentic speckle pattern images for training the Convolutional Neural Networks. The models are designed to be robust and versatile, offering a promising alternative to traditional measurement techniques and paving the way for advanced applications in three-dimensional modeling. This advancement signifies a shift towards more efficient and dynamic structural health monitoring by leveraging the power of Artificial Intelligence for real-time simulation and analysis.
Data integration methods aim to extract low-dimensional embeddings from high-dimensional outcomes to remove unwanted variations, such as batch effects and unmeasured covariates, across heterogeneous datasets. However, multiple hypothesis testing after integration can be biased due to data-dependent processes. We introduce a robust post-integrated inference (PII) method that adjusts for latent heterogeneity using negative control outcomes. Leveraging causal interpretations, we derive nonparametric identifiability of the direct effects, which motivates our semiparametric inference method. Our method extends to projected direct effect estimands, accounting for hidden mediators, confounders, and moderators. These estimands remain statistically meaningful under model misspecifications and with error-prone embeddings. We provide bias quantifications and finite-sample linear expansions with uniform concentration bounds. The proposed doubly robust estimators are consistent and efficient under minimal assumptions and potential misspecification, facilitating data-adaptive estimation with machine learning algorithms. Our proposal is evaluated with random forests through simulations and analysis of single-cell CRISPR perturbed datasets with potential unmeasured confounders.
Epilepsy affects around 50 million people globally. Electroencephalography (EEG) or Magnetoencephalography (MEG) based spike detection plays a crucial role in diagnosis and treatment. Manual spike identification is time-consuming and requires specialized training that further limits the number of qualified professionals. To ease the difficulty, various algorithmic approaches have been developed. However, the existing methods face challenges in handling varying channel configurations and in identifying the specific channels where the spikes originate. A novel Nested Deep Learning (NDL) framework is proposed to overcome these limitations. NDL applies a weighted combination of signals across all channels, ensuring adaptability to different channel setups, and allows clinicians to identify key channels more accurately. Through theoretical analysis and empirical validation on real EEG/MEG datasets, NDL is shown to improve prediction accuracy, achieve channel localization, support cross-modality data integration, and adapt to various neurophysiological applications.