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Related papers: Physics-Enhanced Machine Learning: a position pape…

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We introduce a machine-learning (ML) framework for high-throughput benchmarking of diverse representations of chemical systems against datasets of materials and molecules. The guiding principle underlying the benchmarking approach is to…

Machine Learning · Computer Science 2021-12-07 Carl Poelking , Felix A. Faber , Bingqing Cheng

Chemists in search of structure-property relationships face great challenges due to limited high quality, concordant datasets. Machine learning (ML) has significantly advanced predictive capabilities in chemical sciences, but these modern…

Machine Learning · Computer Science 2025-09-18 Yulia Pimonova , Michael G. Taylor , Alice Allen , Ping Yang , Nicholas Lubbers

Learning Progressions (LPs) can help adjust instruction to individual learners needs if the LPs reflect diverse ways of thinking about a construct being measured, and if the LP-aligned assessments meaningfully measure this diversity. The…

Computers and Society · Computer Science 2025-09-26 Leonora Kaldaras , Tingting Li , Prudence Djagba , Kevin Haudek , Joseph Krajcik

Large Language Models (LLMs) have shown impressive performance in domains such as mathematics and programming, yet their capabilities in physics remain underexplored and poorly understood. Physics poses unique challenges that demand not…

Depending on the point of view, modern machine learning is either providing an unprecedented boost to the numerical methods of particle physics, or it is transforming the way we do science with vast amounts of complex data. In any case, it…

High Energy Physics - Phenomenology · Physics 2025-04-25 Tilman Plehn , Anja Butter , Barry Dillon , Theo Heimel , Claudius Krause , Ramon Winterhalder

Recent advances in deep learning for solving partial differential equations (PDEs) have introduced physics-informed neural networks (PINNs), which integrate machine learning with physical laws. Physics-informed convolutional neural networks…

Computational Engineering, Finance, and Science · Computer Science 2025-11-11 Wanyun Zhou , Haoze Song , Xiaowen Chu

Physics Informed Neural Networks is a numerical method which uses neural networks to approximate solutions of partial differential equations. It has received a lot of attention and is currently used in numerous physical and engineering…

Numerical Analysis · Mathematics 2025-07-10 Dimitrios Gazoulis , Ioannis Gkanis , Charalambos G. Makridakis

Scientific reasoning, the process through which humans apply logic, evidence, and critical thinking to explore and interpret scientific phenomena, is essential in advancing knowledge reasoning across diverse fields. However, despite…

Computation and Language · Computer Science 2026-04-21 Yibo Yan , Shen Wang , Jiahao Huo , Jingheng Ye , Zhendong Chu , Xuming Hu , Philip S. Yu , Carla Gomes , Bart Selman , Qingsong Wen

The recent progresses in Machine Learning opened the door to actual applications of learning algorithms but also to new research directions both in the field of Machine Learning directly and, at the edges with other disciplines. The case…

Disordered Systems and Neural Networks · Physics 2023-07-17 Aurélien Decelle

In this survey, we discuss the challenges of executing scientific workflows as well as existing Machine Learning (ML) techniques to alleviate those challenges. We provide the context and motivation for applying ML to each step of the…

Distributed, Parallel, and Cluster Computing · Computer Science 2021-10-28 Azita Nouri , Philip E. Davis , Pradeep Subedi , Manish Parashar

"Human-centered machine learning" (HCML) is a term that describes machine learning that applies to human-focused problems. Although this idea is noteworthy and generates scholarly excitement, scholars and practitioners have struggled to…

Machine Learning · Computer Science 2022-03-02 Stevie Chancellor

The use of machine learning in Structural Health Monitoring is becoming more common, as many of the inherent tasks (such as regression and classification) in developing condition-based assessment fall naturally into its remit. This chapter…

Machine Learning · Computer Science 2022-07-01 Elizabeth J Cross , Samuel J Gibson , Matthew R Jones , Daniel J Pitchforth , Sikai Zhang , Timothy J Rogers

To learn about real world phenomena, scientists have traditionally used models with clearly interpretable elements. However, modern machine learning (ML) models, while powerful predictors, lack this direct elementwise interpretability (e.g.…

Machine Learning · Statistics 2024-07-16 Timo Freiesleben , Gunnar König , Christoph Molnar , Alvaro Tejero-Cantero

This position paper outlines the potential of AutoML for incremental (continual) learning to encourage more research in this direction. Incremental learning involves incorporating new data from a stream of tasks and distributions to learn…

Machine Learning · Computer Science 2023-11-21 Mert Kilickaya , Joaquin Vanschoren

We demonstrate that embedding physics-driven constraints into machine learning process can dramatically improve accuracy and generalizability of the resulting model. Physics-informed learning is illustrated on the example of analysis of…

Computational Physics · Physics 2021-12-16 Abantika Ghosh , Mohannad Elhamod , Jie Bu , Wei-Cheng Lee , Anuj Karpatne , Viktor A Podolskiy

Representation learning has been widely studied in the context of meta-learning, enabling rapid learning of new tasks through shared representations. Recent works such as MAML have explored using fine-tuning-based metrics, which measure the…

Machine Learning · Computer Science 2021-05-06 Kurtland Chua , Qi Lei , Jason D. Lee

Machine learning algorithms increasingly influence our decisions and interact with us in all parts of our daily lives. Therefore, just as we consider the safety of power plants, highways, and a variety of other engineered socio-technical…

Computers and Society · Computer Science 2017-08-23 Kush R. Varshney , Homa Alemzadeh

Modeling stiff partial differential equations (PDEs) with sharp gradients remains a significant challenge for scientific machine learning. While Physics-Informed Neural Networks (PINNs) struggle with spectral bias and slow training times,…

Computational Engineering, Finance, and Science · Computer Science 2026-03-09 Akshay Govind Srinivasan , Balaji Srinivasan

Physics-informed neural networks (PINNs) have emerged as a promising approach to solving partial differential equations (PDEs) using neural networks, particularly in data-scarce scenarios, due to their unsupervised training capability.…

Machine Learning · Computer Science 2025-03-25 Edgar Torres , Jonathan Schiefer , Mathias Niepert

Due to the increasing system stability issues caused by the technological revolutions of power system equipment, the assessment of the dynamic security of the systems for changing operating conditions (OCs) is nowadays crucial. To address…

Systems and Control · Electrical Eng. & Systems 2023-04-11 Haiwei Xie , Federica Bellizio , Jochen L. Cremer , Goran Strbac