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A version of the time-parallel algorithm parareal is analyzed and applied to stochastic models in chemical kinetics. A fast predictor at the macroscopic scale (evaluated in serial) is available in the form of the usual reaction rate…

Numerical Analysis · Mathematics 2009-09-16 Stefan Engblom

Heterogeneous Information Network (HIN) embedding refers to the low-dimensional projections of the HIN nodes that preserve the HIN structure and semantics. HIN embedding has emerged as a promising research field for network analysis as it…

Machine Learning · Computer Science 2021-08-10 Rayyan Ahmad Khan , Martin Kleinsteuber

Electromagnetic computations, where the wavelength is small in relation to the geometry of interest, become computationally demanding. In order to manage computations for realistic problems like electromagnetic scattering from aircraft, the…

Computational Engineering, Finance, and Science · Computer Science 2018-01-12 Afshin Zafari , Elisabeth Larsson , Marco Righero , M. Alessandro Francavilla , Giorgio Giordanengo , Francesca Vipiana , Giuseppe Vecchi

Heterogeneous graph neural networks (HGNNs) were proposed for representation learning on structural data with multiple types of nodes and edges. To deal with the performance degradation issue when HGNNs become deep, researchers combine…

Machine Learning · Computer Science 2023-11-27 Xinyu Fu , Irwin King

This paper presents a non-manual design engineering method based on heuristic search algorithm to search for candidate agents in the solution space which formed by artificial intelligence agents modeled on the base of bionics.Compared with…

Artificial Intelligence · Computer Science 2018-07-30 Zengkun Li

We introduce a model-based asynchronous multi-fidelity method for hyperparameter and neural architecture search that combines the strengths of asynchronous Hyperband and Gaussian process-based Bayesian optimization. At the heart of our…

Machine Learning · Computer Science 2020-07-01 Aaron Klein , Louis C. Tiao , Thibaut Lienart , Cedric Archambeau , Matthias Seeger

We present magneto-hydrodynamic simulation results for heterogeneous systems. Heterogeneous architectures combine high floating point performance many-core units hosted in conventional server nodes. Examples include Graphics Processing…

Performance · Computer Science 2010-11-04 Bijia Pang , Ue-li Pen , Michael Perrone

Metasurfaces, with their ability to control electromagnetic waves, hold immense potential in optical device design, especially for applications requiring precise control over dispersion. This work introduces an approach to dispersion…

We present a computational algorithm for computing short range forces between particles. The algorithm has two distinguishing features. First, it is optimized for multi-processor computers, and will use as many processors as are available.…

Astrophysics · Physics 2008-02-03 Robert C. Ferrell , Edmund Bertschinger

In this paper we describe HeSP, a complete simulation framework to study a general task scheduling-partitioning problem on heterogeneous architectures, which treats recursive task partitioning and scheduling decisions on equal footing.…

Distributed, Parallel, and Cluster Computing · Computer Science 2016-02-18 Anton Rey , Francisco D. Igual , Manuel Prieto-Matías

After Industry 4.0 has embraced tight integration between machinery (OT), software (IT), and the Internet, creating a web of sensors, data, and algorithms in service of efficient and reliable production, a new concept of Society 5.0 is…

Access to parallel and distributed computation has enabled researchers and developers to improve algorithms and performance in many applications. Recent research has focused on next generation special purpose systems with multiple kinds of…

Machine Learning · Computer Science 2019-06-11 Tegg Taekyong Sung , Valliappa Chockalingam , Alex Yahja , Bo Ryu

Metaheuristic algorithms are currently widely used to solve a variety of optimization problems across various industries. This article discusses the application of a metaheuristic algorithm to optimize the hierarchical architecture of an…

Systems and Control · Electrical Eng. & Systems 2026-03-13 Ruslan Zakirzyanov

The combination of Internet of Things (IoT) and Edge Computing (EC) can assist in the delivery of novel applications that will facilitate end users activities. Data collected by numerous devices present in the IoT infrastructure can be…

Databases · Computer Science 2020-08-13 Kostas Kolomvatsos , Christos Anagnostopoulos

Medicinal synergy prediction is a powerful tool in drug discovery and development that harnesses the principles of combination therapy to enhance therapeutic outcomes by improving efficacy, reducing toxicity, and preventing drug resistance.…

Computational Engineering, Finance, and Science · Computer Science 2024-11-26 Jiawei Wu , Jun Wen , Mingyuan Yan , Anqi Dong , Shuai Gao , Ren Wang , Can Chen

We consider the prediction of the Hamiltonian matrix, which finds use in quantum chemistry and condensed matter physics. Efficiency and equivariance are two important, but conflicting factors. In this work, we propose a SE(3)-equivariant…

Machine Learning · Computer Science 2023-11-09 Haiyang Yu , Zhao Xu , Xiaofeng Qian , Xiaoning Qian , Shuiwang Ji

The disconnect between AI-generated molecules with desirable properties and their synthetic feasibility remains a critical bottleneck in computational discovery of drugs and materials. While generative AI has accelerated the proposal of…

Chemical Physics · Physics 2025-11-25 Shuan Chen , Gunwook Nam , Alan Aspuru-Guzik , Yousung Jung

Heterogeneous graph neural architecture search (HGNAS) represents a powerful tool for automatically designing effective heterogeneous graph neural networks. However, existing HGNAS algorithms suffer from inefficient searches and unstable…

Artificial Intelligence · Computer Science 2023-12-15 Haoyuan Dong , Yang Gao , Haishuai Wang , Hong Yang , Peng Zhang

Cassandra is a popular structured storage system with high-performance, scalability and high availability, and is usually used to store data that has some sortable attributes. When deploying and configuring Cassandra, it is important to…

Databases · Computer Science 2018-10-03 Jialin Qiao , Xiangdong Huang , Lei Rui , Jianmin Wang

We describe an approach that uses combinatorial optimization and machine learning to share the work between the host and device of heterogeneous computing systems such that the overall application execution time is minimized. We propose to…

Distributed, Parallel, and Cluster Computing · Computer Science 2016-06-17 Suejb Memeti , Sabri Pllana