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With the establishment of machine learning (ML) techniques in the scientific community, the construction of ML potential energy surfaces (ML-PES) has become a standard process in physics and chemistry. So far, improvements in the…

Chemical Physics · Physics 2024-07-23 Kai Töpfer , Luis Itza Vazquez-Salazar , Markus Meuwly

The increasing popularity of deep learning models has created new opportunities for developing AI-based recommender systems. Designing recommender systems using deep neural networks requires careful architecture design, and further…

Information Retrieval · Computer Science 2024-11-13 Tunhou Zhang , Dehua Cheng , Yuchen He , Zhengxing Chen , Xiaoliang Dai , Liang Xiong , Yudong Liu , Feng Cheng , Yufan Cao , Feng Yan , Hai Li , Yiran Chen , Wei Wen

We describe a framework to assemble permanent-magnet cubes in 3D-printed frames to construct dipole, quadrupole, and solenoid magnets, whose field, in the absence of iron, can be calculated analytically in three spatial dimensions. Rotating…

Accelerator Physics · Physics 2021-12-06 Volker Ziemann

Developing complex biomolecular workflows is not always straightforward. It requires tedious developments to enable the interoperability between the different biomolecular simulation and analysis tools. Moreover, the need to execute the…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-12-20 Jorge Ejarque , Pau Andrio , Adam Hospital , Javier Conejero , Daniele Lezzi , Josep LL. Gelpi , Rosa M. Badia

We present the simulation framework CRPropa version 3 designed for efficient development of astrophysical predictions for ultra-high energy particles. Users can assemble modules of the most relevant propagation effects in galactic and…

Instrumentation and Methods for Astrophysics · Physics 2016-05-26 Rafael Alves Batista , Andrej Dundovic , Martin Erdmann , Karl-Heinz Kampert , Daniel Kuempel , Gero Müller , Guenter Sigl , Arjen van Vliet , David Walz , Tobias Winchen

In this letter, we propose a novel three-dimensional conceptual model for an emerging service-oriented simulation paradigm. The model can be used as a guideline or an analytic means to find the potential and possible future directions of…

Software Engineering · Computer Science 2009-09-21 Wenguang Wang , Weiping Wang , Justyna Zander , Yifan Zhu

Hydrodynamical simulations are increasingly able to accurately model physical systems on stellar, galactic, and cosmological scales, however, the utility of these simulations is often limited by our ability to directly compare them with the…

Instrumentation and Methods for Astrophysics · Physics 2017-09-26 Cameron Hummels , Britton Smith , Devin Silvia

AnyMOD.jl is a Julia framework for creating large-scale energy system models with multiple periods of capacity expansion. It applies a novel graphbased approach that was developed to address the challenges in modeling high levels of…

Physics and Society · Physics 2022-12-21 Leonard Göke

Simulation has become an essential component of designing and developing scientific experiments. The conventional procedural approach to coding simulations of complex experiments is often error-prone, hard to interpret, and inflexible,…

Computational Physics · Physics 2023-08-09 Peter Sun , John A. Marohn

$clustertools$ is a Python package for analyzing star cluster simulations. The package is built around the $StarCluster$ class, which stores all data read in from the snapshot of a given model star cluster. The package contains functions…

Astrophysics of Galaxies · Physics 2023-05-22 Jeremy J. Webb

Improvement of time series forecasting accuracy through combining multiple models is an important as well as a dynamic area of research. As a result, various forecasts combination methods have been developed in literature. However, most of…

Artificial Intelligence · Computer Science 2013-02-28 Ratnadip Adhikari , R. K. Agrawal

With recent increasing computational and data requirements of scientific applications, the use of large clustered systems as well as distributed resources is inevitable. Although executing large applications in these environments brings…

Distributed, Parallel, and Cluster Computing · Computer Science 2011-06-30 Alexandru Costan , Florin Pop , Corina Stratan , Ciprian Dobre , Catalin Leordeanu , Valentin Cristea

This article introduces a metamodel for the Business Model Canvas (BMC) using the Unified Modelling Language (UML), together with a dedicated Domain-Specific Modelling Language (DSML) tool. Although the BMC is widely adopted by both…

Software Engineering · Computer Science 2026-02-16 Nordine Benkeltoum

Multiple patterning lithography has been widely adopted in advanced technology nodes of VLSI manufacturing. As a key step in the design flow, multiple patterning layout decomposition (MPLD) is critical to design closure. Due to the…

Other Computer Science · Computer Science 2019-09-17 Wei Li , Yuzhe Ma , Qi Sun , Yibo Lin , Iris Hui-Ru Jiang , Bei Yu , David Z. Pan

Data scientists seeking a good supervised learning model on a new dataset have many choices to make: they must preprocess the data, select features, possibly reduce the dimension, select an estimation algorithm, and choose hyperparameters…

Machine Learning · Computer Science 2020-06-11 Chengrun Yang , Jicong Fan , Ziyang Wu , Madeleine Udell

The paper presents our system developed for table question answering (TQA). TQA tasks face challenges due to the characteristics of real-world tabular data, such as large size, incomplete column semantics, and entity ambiguity. To address…

Artificial Intelligence · Computer Science 2025-07-14 Sishi Xiong , Dakai Wang , Yu Zhao , Jie Zhang , Changzai Pan , Haowei He , Xiangyu Li , Wenhan Chang , Zhongjiang He , Shuangyong Song , Yongxiang Li

SkyPy is an open-source Python package for simulating the astrophysical sky. It comprises a library of physical and empirical models across a range of observables and a command-line script to run end-to-end simulations. The library provides…

Simulating a survey of fluxes and redshifts (distances) from an astrophysical population is a routine task. \texttt{popsynth} provides a generic, object-oriented framework to produce synthetic surveys from various distributions and…

Instrumentation and Methods for Astrophysics · Physics 2021-07-20 J. Michael Burgess , Francesca Capel

Astronomical software is now a fact of daily life for all hands-on members of our community. Purpose-built software for data reduction and modeling tasks becomes ever more critical as we handle larger amounts of data and simulations.…

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