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We tackle the challenge of predicting vibrational stability in inorganic semiconductors for high-throughput screening, an essential attribute for evaluating synthesizability alongside thermodynamic stability, frequently missing in prominent…

Materials Science · Physics 2025-12-29 M. H. Zeb , M. Z. Kabir

Purpose: We address the challenge of inaccurate parameter estimation in diffusion MRI when the signal-to-noise ratio (SNR) is very low, as in the spinal cord. The accuracy of conventional maximum-likelihood estimation (MLE) depends highly…

Physics-informed neural networks (PINNs) have demonstrated promise as a framework for solving forward and inverse problems involving partial differential equations. Despite recent progress in the field, it remains challenging to quantify…

Machine Learning · Computer Science 2025-11-14 Bruno Jacob , Ashish S. Nair , Amanda A. Howard , Jan Drgona , Panos Stinis

Multiple Instance Learning (MIL) is a weakly-supervised problem in which one label is assigned to the whole bag of instances. An important class of MIL models is instance-based, where we first classify instances and then aggregate those…

Image and Video Processing · Electrical Eng. & Systems 2024-03-13 Łukasz Struski , Dawid Rymarczyk , Arkadiusz Lewicki , Robert Sabiniewicz , Jacek Tabor , Bartosz Zieliński

A significant advancement in Neural Network (NN) research is the integration of domain-specific knowledge through custom loss functions. This approach addresses a crucial challenge: how can models utilize physics or mathematical principles…

Machine Learning · Computer Science 2025-03-27 Seyedeh Azadeh Fallah Mortezanejad , Ruochen Wang , Ali Mohammad-Djafari

Physics-informed neural networks (PINNs) constitute a flexible deep learning approach for solving partial differential equations (PDEs), which model phenomena ranging from heat conduction to quantum mechanical systems. Despite their…

Machine Learning · Computer Science 2026-03-17 Aleksander Krasowski , René P. Klausen , Aycan Celik , Sebastian Lapuschkin , Wojciech Samek , Jonas Naujoks

This paper introduces a novel approach to solve inverse problems by leveraging deep learning techniques. The objective is to infer unknown parameters that govern a physical system based on observed data. We focus on scenarios where the…

Machine Learning · Computer Science 2023-10-02 Sidney Besnard , Frédéric Jurie , Jalal M. Fadili

Physics-informed deep learning has drawn tremendous interest in recent years to solve computational physics problems, whose basic concept is to embed physical laws to constrain/inform neural networks, with the need of less data for training…

Fluid Dynamics · Physics 2020-11-24 Chengping Rao , Hao Sun , Yang Liu

Recent advances in imitative reinforcement learning (IRL) have considerably enhanced the ability of autonomous agents to assimilate expert demonstrations, leading to rapid skill acquisition in a range of demanding tasks. However, such…

Robotics · Computer Science 2025-06-26 Hang Zhou , Yihao Qin , Dan Xu , Yiding Ji

Traditional data-driven deep learning models often struggle with high training costs, error accumulation, and poor generalizability in complex physical processes. Physics-informed deep learning (PiDL) addresses these challenges by…

Machine Learning · Computer Science 2024-01-17 Xin-Yang Liu , Min Zhu , Lu Lu , Hao Sun , Jian-Xun Wang

To address the sensitivity of parameters and limited precision for physics-informed extreme learning machines (PIELM) with common activation functions, such as sigmoid, tangent, and Gaussian, in solving high-order partial differential…

Numerical Analysis · Mathematics 2024-11-06 Xi'an Li , Jinran Wu , Yujia Huang , Zhe Ding , Xin Tai , Liang Liu , You-Gan Wang

Calibrating mathematical models of biological processes is essential for achieving predictive accuracy and gaining mechanistic insight. However, this task remains challenging due to limited and noisy data, significant biological…

Quantitative Methods · Quantitative Biology 2025-12-04 Piotr Gwiazda , Alexey Kazarnikov , Anna Marciniak-Czochra , Zuzanna Szymańska

The unprecedented amount of data generated from experiments, field observations, and large-scale numerical simulations at a wide range of spatio-temporal scales have enabled the rapid advancement of data-driven and especially deep learning…

Computational Physics · Physics 2024-06-19 Suraj Pawar , Omer San , Aditya Nair , Adil Rasheed , Trond Kvamsdal

Multi-Instance Learning (MIL) has shown impressive performance for histopathology whole slide image (WSI) analysis using bags or pseudo-bags. It involves instance sampling, feature representation, and decision-making. However, existing…

Computer Vision and Pattern Recognition · Computer Science 2024-03-14 Tingting Zheng , Kui Jiang , Hongxun Yao

In this research, the application of the Physics-Informed Neural Network (PINN) model is explored to solve transport equation-based Partial Differential Equations (PDEs). The primary objective is to analyze the impact of different…

Machine Learning · Computer Science 2023-12-04 Akshansh Mishra

The paper presents an efficient and robust data-driven deep learning (DL) computational framework developed for linear continuum elasticity problems. The methodology is based on the fundamentals of the Physics Informed Neural Networks…

Machine Learning · Computer Science 2023-02-21 Arunabha M. Roy , Rikhi Bose

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

The development of robust and reliable modeling approaches for crystallization processes is often challenging because of non-idealities in real data arising from various sources of uncertainty. This study investigated the effectiveness of…

Computational Engineering, Finance, and Science · Computer Science 2026-02-10 Dingqi Nai , Huayu Li , Martha Grover , Andrew Medford

This paper develops a unified estimation framework, the Maximum Ideal Likelihood Estimation (MILE), for general parametric models with latent variables. Unlike traditional approaches relying on the marginal likelihood of the observed data,…

Statistics Theory · Mathematics 2025-10-08 Yizhou Cai , Ting Fung Ma

We propose Conformal Mixed-Integer Constraint Learning (C-MICL), a novel framework that provides probabilistic feasibility guarantees for data-driven constraints in optimization problems. While standard Mixed-Integer Constraint Learning…

Machine Learning · Computer Science 2025-06-05 Daniel Ovalle , Lorenz T. Biegler , Ignacio E. Grossmann , Carl D. Laird , Mateo Dulce Rubio