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Blue Waters is a Petascale-level supercomputer whose mission is to enable the national scientific and research community to solve "grand challenge" problems that are orders of magnitude more complex than can be carried out on other high…

Tackling the most pressing problems for humanity, such as the climate crisis and the threat of global pandemics, requires accelerating the pace of scientific discovery. While science has traditionally relied on trial and error and even…

Machine Learning · Computer Science 2023-06-28 Moksh Jain , Tristan Deleu , Jason Hartford , Cheng-Hao Liu , Alex Hernandez-Garcia , Yoshua Bengio

Workflows provide an expressive programming model for fine-grained control of large-scale applications in distributed computing environments. Accurate estimates of complex workflow execution metrics on large-scale machines have several key…

Distributed, Parallel, and Cluster Computing · Computer Science 2018-04-18 Alok Singh , Mai Nguyen , Shweta Purawat , Daniel Crawl , Ilkay Altintas

A bottleneck can largely deteriorate the flow, such as a traffic light or an on-ramp at a road. To alleviate bottleneck situations, one of the important strategies is to control the input rate to suit the state of the road. In this study,…

Cellular Automata and Lattice Gases · Physics 2019-03-28 Hiroki Yamamoto , Daichi Yanagisawa , Katsuhiro Nishinari

Artificial intelligence systems for scientific discovery have demonstrated remarkable potential, yet existing approaches remain largely proprietary and operate in batch-processing modes requiring hours per research cycle, precluding…

Artificial Intelligence · Computer Science 2026-01-28 Lukas Weidener , Marko Brkić , Mihailo Jovanović , Ritvik Singh , Chiara Baccin , Emre Ulgac , Alex Dobrin , Aakaash Meduri

In daily life situations, we have to perform multiple tasks given a visual stimulus, which requires task-relevant information to be transmitted through our visual system. When it is not possible to transmit all the possibly relevant…

Neurons and Cognition · Quantitative Biology 2019-09-24 Sushrut Thorat , Giacomo Aldegheri , Marcel A. J. van Gerven , Marius V. Peelen

AI scientist systems, capable of autonomously executing the full research workflow from hypothesis generation and experimentation to paper writing, hold significant potential for accelerating scientific discovery. However, the internal…

Artificial Intelligence · Computer Science 2025-12-23 Ziming Luo , Atoosa Kasirzadeh , Nihar B. Shah

Advances in technology and computing hardware are enabling scientists from all areas of science to produce massive amounts of data using large-scale simulations or observational facilities. In this era of data deluge, effective coordination…

Databases · Computer Science 2015-03-31 Spyros Blanas , Surendra Byna

With the advent of Grid and application technologies, scientists and engineers are building more and more complex applications to manage and process large data sets, and execute scientific experiments on distributed resources. Such…

Distributed, Parallel, and Cluster Computing · Computer Science 2007-05-23 Jia Yu , Rajkumar Buyya

Scientific workflows automate the analysis of large-scale scientific data, fostering the reuse of data processing operators as well as the reproducibility and traceability of analysis results. In exploratory research, however, workflows are…

Other Computer Science · Computer Science 2023-09-26 Sebastian Pohl , Nourhan Elfaramawy , Kedi Cao , Birte Kehr , Matthias Weidlich

Currently, knowledge discovery in databases is an essential step to identify valid, novel and useful patterns for decision making. There are many real-world scenarios, such as bankruptcy prediction, option pricing or medical diagnosis,…

Artificial Intelligence · Computer Science 2018-11-20 José-Ramón Cano , Pedro Antonio Gutiérrez , Bartosz Krawczyk , Michał Woźniak , Salvador García

Pipeline is a fundamental parallel programming pattern. Mainstream pipeline programming frameworks count on data abstractions to perform pipeline scheduling. This design is convenient for data-centric pipeline applications but inefficient…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-02-03 Cheng-Hsiang Chiu , Tsung-Wei Huang , Zizheng Guo , Yibo Lin

Growing anthropogenic pressures have increased the need for robust predictive models. Meeting this demand requires approaches that can handle bigger data to yield forecasts that capture the variability and underlying uncertainty of…

Quantitative Methods · Quantitative Biology 2024-08-06 EM Wolkovich , T Jonathan Davies , William D Pearse , Michael Betancourt

The ability to extract relevant information is critical to learning. An ingenious approach as such is the information bottleneck, an optimisation problem whose solution corresponds to a faithful and memory-efficient representation of…

Quantum Physics · Physics 2023-03-08 Masahito Hayashi , Yuxiang Yang

As Large Language Models (LLMs) become ubiquitous across various scientific domains, their lack of ability to perform complex tasks like running simulations or to make complex decisions limits their utility. LLM-based agents bridge this gap…

Computation and Language · Computer Science 2026-01-21 Anurag Acharya , Timothy Vega , Rizwan A. Ashraf , Anshu Sharma , Derek Parker , Robert Rallo

Scientific research is being reshaped by AI systems that move beyond isolated assistance toward longer-horizon workflows spanning literature grounding, hypothesis generation, experimentation, validation, reporting, and revision. This shift…

The development and deployment of safe and dependable AI models is crucial in applications where functional safety is a key concern. Given the rapid advancement in AI research and the relative novelty of the safe-AI domain, there is an…

Software Engineering · Computer Science 2025-03-21 Suzana Veljanovska , Hans Dermot Doran

Dataflow devices represent an avenue towards saving the control and data movement overhead of Load-Store Architectures. Various dataflow accelerators have been proposed, but how to efficiently schedule applications on such devices remains…

Distributed, Parallel, and Cluster Computing · Computer Science 2023-06-06 Tiziano De Matteis , Lukas Gianinazzi , Johannes de Fine Licht , Torsten Hoefler

Scientific workflow is a powerful tool to streamline and organize computational steps of scientific application. This paper presents Emerald, a system that adds sophisticated cloud offloading capabilities to scientific workflows. Emerald…

Distributed, Parallel, and Cluster Computing · Computer Science 2017-10-05 Hao Qian

Despite strong results on many tasks, multimodal large language models (MLLMs) still underperform on visual mathematical problem solving, especially in reliably perceiving and interpreting diagrams. Inspired by human problem-solving, we…

Computer Vision and Pattern Recognition · Computer Science 2026-04-21 Shuhang Chen , Hangjie Yuan , Yunqiu Xu , Pengwei Liu , Tao Feng , Jun Cen , Zeying Huang , Yi Yang