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Molecular dynamics simulations are an invaluable tool in numerous scientific fields. However, the ubiquitous classical force fields cannot describe reactive systems, and quantum molecular dynamics are too computationally demanding to treat…

Chemical Physics · Physics 2022-08-09 Xiangyun Lei , Andrew J. Medford

Learning mappings between functional spaces, also known as function-on-function regression, is a fundamental problem in functional data analysis with broad applications, including spatiotemporal forecasting, curve prediction, and climate…

Machine Learning · Computer Science 2026-04-07 Matthew Lowery , Zhitong Xu , Da Long , Keyan Chen , Daniel S. Johnson , Yang Bai , Varun Shankar , Shandian Zhe

A novel Gibbs Markov random field for spatial data on Cartesian grids based on the modified planar rotator (MPR) model of statistical physics has been recently introduced for efficient and automatic interpolation of big data sets, such as…

Computational Physics · Physics 2019-10-21 Milan Žukovič , Michal Borovský , Matúš Lach , Dionissios T. Hristopulos

Real-time and collision-free motion planning remains challenging for robotic manipulation in unknown environments due to continuous perception updates and the need for frequent online replanning. To address these challenges, we propose a…

Robotics · Computer Science 2025-12-30 Xuewei Zhang , Bailing Tian , Kai Zheng , Yulin Hui , Junjie Lu , Zhiyu Li

We present a new algorithm for convex separable quadratic programming (QP) called Nys-IP-PMM, a regularized interior-point solver that uses low-rank structure to accelerate solution of the Newton system. The algorithm combines the interior…

Optimization and Control · Mathematics 2025-01-15 Ya-Chi Chu , Luiz-Rafael Santos , Madeleine Udell

This paper proposes a novel framework for implicit multi-camera system calibration utilizing Gaussian Process (GP) regression. Conventional explicit calibration methods are constrained by rigid mathematical models and struggle with complex,…

Computer Vision and Pattern Recognition · Computer Science 2026-05-11 Ivan De Boi , Bart Ribbens , Veronika Golanova , Ursula Kapov , Simon Verspeek

Implicit time integration is key to robustly simulating stiff materials and large deformations, but its performance is often dominated by repeatedly solving large linear systems. Adaptive coarsening can reduce this cost by concentrating…

Graphics · Computer Science 2026-05-07 Xuan Wang , Zhaofeng Luo , Minchen Li , Taku Komura , Kemeng Huang

When learning simulations for modeling physical phenomena in industrial designs, geometrical variabilities are of prime interest. While classical regression techniques prove effective for parameterized geometries, practical scenarios often…

Machine Learning · Computer Science 2023-10-24 Fabien Casenave , Brian Staber , Xavier Roynard

In recent years, imitation learning has made progress in the field of robotic manipulation. However, it still faces challenges when addressing complex long-horizon tasks with deformable objects, such as high-dimensional state spaces,…

Robotics · Computer Science 2025-03-14 Wendi Chen , Han Xue , Fangyuan Zhou , Yuan Fang , Cewu Lu

Although learned video compression methods have exhibited outstanding performance, most of them typically follow a hybrid coding paradigm that requires explicit motion estimation and compensation, resulting in a complex solution for video…

Computer Vision and Pattern Recognition · Computer Science 2026-03-10 Hao Wei , Yanhui Zhou , Chenyang Ge

The Immersed Boundary Method (IBM) is one of the popular one-fluid mixed Eulerian-Lagrangian methods to simulate motion of droplets. While the treatment of a moving complex boundary is an extremely time consuming and formidable task in a…

Computational Physics · Physics 2018-07-30 Chia Rui Ong , Hiroaki Miura

Implicit neural representations have emerged as a powerful approach for encoding complex geometries as continuous functions. These implicit models are widely used in computer vision and 3D content creation, but their integration into…

This paper presents a high-performance framework for three-dimensional gravity modeling and inversion implemented in Julia, addressing key challenges in geophysical modeling such as computational complexity, ill-posedness, and the…

Geophysics · Physics 2026-02-05 Nimatullah , Pankaj K Mishra , Jochen Kamm , Anand Singh

Whereas dedicated scene representations are required for each different task in conventional robotic systems, this paper demonstrates that a unified representation can be used directly for multiple key tasks. We propose the Log-Gaussian…

Robotics · Computer Science 2024-10-24 Lan Wu , Ki Myung Brian Lee , Cedric Le Gentil , Teresa Vidal-Calleja

We propose Hierarchical Optimization Time Integration (HOT) for efficient implicit time-stepping of the Material Point Method (MPM) irrespective of simulated materials and conditions. HOT is an MPM-specialized hierarchical optimization…

Graphics · Computer Science 2020-04-28 Xinlei Wang , Minchen Li , Yu Fang , Xinxin Zhang , Ming Gao , Min Tang , Danny M. Kaufman , Chenfanfu Jiang

In this work, we introduce the Geometry-Aware Large Reconstruction Model (GeoLRM), an approach which can predict high-quality assets with 512k Gaussians and 21 input images in only 11 GB GPU memory. Previous works neglect the inherent…

Computer Vision and Pattern Recognition · Computer Science 2024-10-29 Chubin Zhang , Hongliang Song , Yi Wei , Yu Chen , Jiwen Lu , Yansong Tang

Graph pattern mining (GPM) is an important application that identifies structures from graphs. Despite the recent progress, the performance gap between the state-of-the-art GPM systems and an efficient algorithm--pattern decomposition--is…

Distributed, Parallel, and Cluster Computing · Computer Science 2022-11-14 Jingji Chen , Xuehai Qian

The present research builds on a recently proposed spatial prediction method for discretized two-dimensional data, based on a suitably modified planar rotator (MPR) spin model from statistical physics. This approach maps the measured data…

Computational Physics · Physics 2020-07-08 Matúš Lach , Michal Borovský , Milan Žukovič

There is growing interest in engineering unconventional computing devices that leverage the intrinsic dynamics of physical substrates to perform fast and energy-efficient computations. Granular metamaterials are one such substrate that has…

Machine Learning · Computer Science 2024-04-09 Atoosa Parsa , Corey S. O'Hern , Rebecca Kramer-Bottiglio , Josh Bongard

Understanding the precise interaction mechanisms between quantum systems and their environment is crucial for advancing stable quantum technologies, designing reliable experimental frameworks, and building accurate models of real-world…

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