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Predicting the physico-chemical properties of pure substances and mixtures is a central task in thermodynamics. Established prediction methods range from fully physics-based ab-initio calculations, which are only feasible for very simple…

Machine Learning · Computer Science 2024-12-02 Johannes Zenn , Dominik Gond , Fabian Jirasek , Robert Bamler

Deep neural networks are a powerful technique that have found ample applications in several branches of Physics. In this work, we apply machine learning algorithms to a specific problem of Cosmic Ray Physics: the estimation of the muon…

Instrumentation and Methods for Astrophysics · Physics 2019-04-10 A. Guillen , A. Bueno , J. M. Carceller , J. C. Martinez-Velazquez , G. Rubio , C. J. Todero Peixoto , P. Sanchez-Lucas

Reliable 4D aircraft trajectory prediction, whether in a real-time setting or for analysis of counterfactuals, is important to the efficiency of the aviation system. Toward this end, we first propose a highly generalizable efficient…

Machine Learning · Computer Science 2019-01-01 Yulin Liu , Mark Hansen

We develop a polycrystal graph neural network (PGNN) model for predicting the effective properties of polycrystalline materials, using the Li7La3Zr2O12 ceramic as an example. A large-scale dataset with >5000 different three-dimensional…

Materials Science · Physics 2023-06-09 Minyi Dai , Mehmet F. Demirel , Xuanhan Liu , Yingyu Liang , Jia-Mian Hu

Molecular dynamics simulations have been extensively used to predict thermal properties, but simulating different phases with similar precision using a unified force field is often difficult, due to the lack of accurate and transferrable…

Materials Science · Physics 2019-12-12 Ruiyang Li , Eungkyu Lee , Tengfei Luo

The extreme and repeated temperature variation during additive manufacturing of metal parts has a large effect on the resulting material microstructure and properties. The ability to accurately predict this temperature field in detail, and…

Applied Physics · Physics 2021-10-15 Lichao Fang , Lin Cheng , Jennifer A. Glerum , Jennifer Bennett , Jian Cao , Gregory J. Wagner

Cryo-electron tomography (Cryo-ET) is a powerful tool in structural biology for 3D visualization of cells and biological systems at resolutions sufficient to identify individual proteins in situ. The measurements are collected by tilting…

Signal Processing · Electrical Eng. & Systems 2025-09-03 Vinith Kishore , Valentin Debarnot , AmirEhsan Khorashadizadeh , Ivan Dokmanić

In many real-world settings, image observations of freely rotating 3D rigid bodies may be available when low-dimensional measurements are not. However, the high-dimensionality of image data precludes the use of classical estimation…

Computer Vision and Pattern Recognition · Computer Science 2024-04-12 Justice Mason , Christine Allen-Blanchette , Nicholas Zolman , Elizabeth Davison , Naomi Ehrich Leonard

Machine learning (ML) is widely used to explore crystal materials and predict their properties. However, the training is time-consuming for deep-learning models, and the regression process is a black box that is hard to interpret. Also, the…

Materials Science · Physics 2023-08-22 Xinyu Jiang , Haofan Sun , Kamal Choudhary , Houlong Zhuang , Qiong Nian

Foundation models, such as CNNs and ViTs, have powered the development of image representation learning. However, general guidance to model architecture design is still missing. Inspired by the connection between image representation…

Computer Vision and Pattern Recognition · Computer Science 2025-06-16 Zhemin Zhang , Xun Gong

As data-driven methods rise in popularity in materials science applications, a key question is how these machine learning models can be used to understand microstructure. Given the importance of process-structure-property relations…

Artificial Intelligence · Computer Science 2017-11-02 Julia Ling , Maxwell Hutchinson , Erin Antono , Brian DeCost , Elizabeth A. Holm , Bryce Meredig

Cryo-electron microscopy (cryo-EM) is capable of producing reconstructed 3D images of biomolecules at near-atomic resolution. As such, it represents one of the most promising imaging techniques in structural biology. However, raw cryo-EM…

Quantitative Methods · Quantitative Biology 2021-05-25 Nina Miolane , Frédéric Poitevin , Yee-Ting Li , Susan Holmes

Recent advances in scanning transmission electron and scanning probe microscopies have opened exciting opportunities in probing the materials structural parameters and various functional properties in real space with angstrom-level…

Pose variation and subtle differences in appearance are key challenges to fine-grained classification. While deep networks have markedly improved general recognition, many approaches to fine-grained recognition rely on anchoring networks to…

Computer Vision and Pattern Recognition · Computer Science 2015-11-24 Ning Zhang , Evan Shelhamer , Yang Gao , Trevor Darrell

Deep learning approaches have shown great success in image classification tasks and can aid greatly towards the fast and reliable classification of pollen grain aerial imagery. However, often-times deep learning methods in the setting of…

Computer Vision and Pattern Recognition · Computer Science 2021-03-01 Jaideep Murkute

While deep learning technologies for computer vision have developed rapidly since 2012, modeling of remote sensing systems has remained focused around human vision. In particular, remote sensing systems are usually constructed to optimize…

Image and Video Processing · Electrical Eng. & Systems 2020-01-08 Lucas Jaffe , Michael Zelinski , Wesam Sakla

In recent years, image recognition method has been a research hotspot in various fields such as video surveillance, biometric identification, unmanned vehicles, human-computer interaction, and medical image recognition. Existing recognition…

Methodology · Statistics 2025-05-12 Yunzhi Jin , Yanqing Zhang , Niansheng Tang

An image-based deep learning framework is developed in this paper to predict damage and failure in microstructure-dependent composite materials. The work is motivated by the complexity and computational cost of high-fidelity simulations of…

Machine Learning · Computer Science 2022-06-07 Reza Sepasdar , Anuj Karpatne , Maryam Shakiba

Differentiating signals from the background in micrographs is a critical initial step for cryogenic electron microscopy (cryo-EM), yet it remains laborious due to low signal-to-noise ratio (SNR), the presence of contaminants and densely…

Image and Video Processing · Electrical Eng. & Systems 2025-09-30 Szu-Chi Chung , Po-Cheng Chou

Wood-composite materials are widely used today as they homogenize humidity related directional deformations. Quantification of these deformations as coefficients is important for construction and engineering and topic of current research…

Computer Vision and Pattern Recognition · Computer Science 2018-02-14 Markus Hofinger , Thomas Pock , Thomas Moosbrugger
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