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相关论文: GenUQ: Predictive Uncertainty Estimates via Genera…

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Neural networks are a commonly used approach to replace physical models with computationally cheap surrogates. Parametric uncertainty quantification can be included in training, assuming that an accurate prior distribution of the model…

机器学习 · 计算机科学 2026-03-12 Heikki Haario , Zhi-Song Liu , Martin Simon , Hendrik Weichel

We consider ill-posed inverse problems where the forward operator $T$ is unknown, and instead we have access to training data consisting of functions $f_i$ and their noisy images $Tf_i$. This is a practically relevant and challenging…

机器学习 · 统计学 2023-02-21 Miguel del Alamo

We introduce a generative learning framework to model high-dimensional parametric systems using gradient guidance and virtual observations. We consider systems described by Partial Differential Equations (PDEs) discretized with structured…

机器学习 · 计算机科学 2024-08-02 Han Gao , Sebastian Kaltenbach , Petros Koumoutsakos

Neural networks are a promising tool for characterizing intermediate-scale quantum devices from limited amounts of measurement data. A challenging problem in this area is to learn the action of an unknown quantum process on an ensemble of…

量子物理 · 物理学 2023-12-06 Yan Zhu , Ya-Dong Wu , Qiushi Liu , Yuexuan Wang , Giulio Chiribella

This study aims to comprehensively investigate the deep ensemble approach, an approximate Bayesian inference, in the multi-output regression task for predicting the aerodynamic performance of a missile configuration. To this end, the effect…

机器学习 · 计算机科学 2023-11-27 Sunwoong Yang , Kwanjung Yee

The classical development of neural networks has primarily focused on learning mappings between finite dimensional Euclidean spaces or finite sets. We propose a generalization of neural networks to learn operators, termed neural operators,…

Uncertainty quantification (UQ) to detect samples with large expected errors (outliers) is applied to reactive molecular potential energy surfaces (PESs). Three methods - Ensembles, Deep Evidential Regression (DER), and Gaussian Mixture…

化学物理 · 物理学 2024-02-28 Luis Itza Vazquez-Salazar , Silvan Käser , Markus Meuwly

Modern implicit generative models such as generative adversarial networks (GANs) are generally known to suffer from issues such as instability, uninterpretability, and difficulty in assessing their performance. If we see these implicit…

机器学习 · 统计学 2019-11-05 Arash Mehrjou , Wittawat Jitkrittum , Krikamol Muandet , Bernhard Schölkopf

Modern implicit generative models such as generative adversarial networks (GANs) are generally known to suffer from issues such as instability, uninterpretability, and difficulty in assessing their performance. If we see these implicit…

机器学习 · 计算机科学 2019-11-07 Arash Mehrjou , Wittawat Jitkrittum , Krikamol Muandet , Bernhard Schölkopf

Stochastic parameterizations account for uncertainty in the representation of unresolved sub-grid processes by sampling from the distribution of possible sub-grid forcings. Some existing stochastic parameterizations utilize data-driven…

大气与海洋物理 · 物理学 2020-04-22 David John Gagne , Hannah M. Christensen , Aneesh C. Subramanian , Adam H. Monahan

An accurate description of information is relevant for a range of problems in atomistic machine learning (ML), such as crafting training sets, performing uncertainty quantification (UQ), or extracting physical insights from large datasets.…

材料科学 · 物理学 2025-05-02 Daniel Schwalbe-Koda , Sebastien Hamel , Babak Sadigh , Fei Zhou , Vincenzo Lordi

Uncertainty Quantification (UQ) is a booming discipline for complex computational models based on the analysis of robustness, reliability and credibility. UQ analysis for nonlinear crash models with high dimensional outputs presents…

计算工程、金融与科学 · 计算机科学 2021-03-31 Marc Rocas , Alberto García-González , Xabier Larrayoz , Pedro Díez

Robust uncertainty quantification (UQ) remains a critical barrier to the safe deployment of deep learning in real-time virtual sensing, particularly in high-stakes domains where sparse, noisy, or non-collocated sensor data are the norm. We…

机器学习 · 计算机科学 2025-07-17 Kazuma Kobayashi , Shailesh Garg , Farid Ahmed , Souvik Chakraborty , Syed Bahauddin Alam

Existing neural networks are memory-consuming and computationally intensive, making deploying them challenging in resource-constrained environments. However, there are various methods to improve their efficiency. Two such methods are…

机器学习 · 计算机科学 2023-11-10 Anastasiia Prutianova , Alexey Zaytsev , Chung-Kuei Lee , Fengyu Sun , Ivan Koryakovskiy

Uncertainty quantification (UQ) methods play an important role in reducing errors in weather forecasting. Conventional approaches in UQ for weather forecasting rely on generating an ensemble of forecasts from physics-based simulations to…

机器学习 · 计算机科学 2024-12-19 Ayush Khot , Xihaier Luo , Ai Kagawa , Shinjae Yoo

The ability to replicate predictions by machine learning (ML) or artificial intelligence (AI) models and results in scientific workflows that incorporate such ML/AI predictions is driven by numerous factors. An uncertainty-aware metric that…

机器学习 · 计算机科学 2023-08-28 Line Pouchard , Kristofer G. Reyes , Francis J. Alexander , Byung-Jun Yoon

We present an approach to quantifying both aleatoric and epistemic uncertainty for deep neural networks in image classification, based on generative adversarial networks (GANs). While most works in the literature that use GANs to generate…

计算机视觉与模式识别 · 计算机科学 2023-01-10 Philipp Oberdiek , Gernot A. Fink , Matthias Rottmann

Modeling uncertainty in deep neural networks, despite recent important advances, is still an open problem. Bayesian neural networks are a powerful solution, where the prior over network weights is a design choice, often a normal…

机器学习 · 统计学 2019-10-29 Raanan Y. Rohekar , Yaniv Gurwicz , Shami Nisimov , Gal Novik

Large molecular representation models pre-trained on massive unlabeled data have shown great success in predicting molecular properties. However, these models may tend to overfit the fine-tuning data, resulting in over-confident predictions…

化学物理 · 物理学 2024-04-18 Yinghao Li , Lingkai Kong , Yuanqi Du , Yue Yu , Yuchen Zhuang , Wenhao Mu , Chao Zhang

Machine Learning has invariantly found its way into various Credit Risk applications. Due to the intrinsic nature of Credit Risk, quantifying the uncertainty of the predicted risk metrics is essential, and applying uncertainty-aware deep…

风险管理 · 定量金融 2023-12-12 Ashish Dhiman
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