arXiv:2505.08709physics.data-ancs.LG2025-05被引 7

用对比归一化流实现物理参数估计的不确定性感知

Contrastive Normalizing Flows for Uncertainty-Aware Parameter Estimation

  • 基于对比归一化流构建数据与参数的映射,提升模型表达能力
  • 在希格斯ML挑战数据集上表现顶尖,抗数据分布偏移能力强
  • 适合高能物理等需精准不确定性量化场景

从数据中估计物理参数是机器学习在物理科学中的关键应用。然而,系统性不确定因素(如探测器校准偏差)会导致数据分布畸变,降低统计精度。在高能物理(HEP)和更广泛的机器学习领域,如何在分布偏移下实现不确定性感知的参数估计仍是开放问题。本文提出一种基于对比归一化流(CNFs)的新方法,适用于一系列对高能物理至关重要的任务,在希格斯ML不确定性挑战数据集上达到顶尖性能。基于二分类器可近似模型参数似然比的洞察,通过学习一个嵌入数据与参数的CNF映射,避免高维参数网格模拟的高昂开销,获得可调的对比分布,从而在分布偏移下实现鲁棒分类。结合理论分析与实证评估,证明当CNFs与分类器及经典频率学方法结合时,可在分布畸变下提供合理参数估计与不确定性量化。

原文摘要 · Abstract (English)

Estimating physical parameters from data is a crucial application of machine learning (ML) in the physical sciences. However, systematic uncertainties, such as detector miscalibration, induce data distribution distortions that can erode statistical precision. In both high-energy physics (HEP) and broader ML contexts, achieving uncertainty-aware parameter estimation under these domain shifts remains an open problem. In this work, we address this challenge of uncertainty-aware parameter estimation for a broad set of tasks critical for HEP. We introduce a novel approach based on Contrastive Normalizing Flows (CNFs), which achieves top performance on the HiggsML Uncertainty Challenge dataset. Building on the insight that a binary classifier can approximate the model parameter likelihood ratio, we address the practical limitations of expressivity and the high cost of simulating high-dimensional parameter grids by embedding data and parameters in a learned CNF mapping. This mapping yields a tunable contrastive distribution that enables robust classification under shifted data distributions. Through a combination of theoretical analysis and empirical evaluations, we demonstrate that CNFs, when coupled with a classifier and established frequentist techniques, provide principled parameter estimation and uncertainty quantification through classification that is robust to data distribution distortions.

参数估计不确定性量化归一化流高能物理

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