用自信感知主动学习提升污染颗粒物属性预测效率
CAAL: Confidence-Aware Active Learning for Heteroscedastic Atmospheric Regression
- 分离预测均值与噪声水平,稳定不确定性估计
- 动态加权认知不确定性,避免在高噪声区浪费标注预算
- 适用于高成本大气颗粒物属性数据扩充,适合气候健康研究
量化空气污染对健康和气候的影响依赖于毒性、吸湿性等关键大气颗粒物属性。这些属性通常需复杂观测或昂贵的粒子解析数值模拟,导致标注数据稀缺。本文从常规观测(如污染物浓度、气象条件)中估算难以测量的颗粒物属性。由于常规观测仅间接反映颗粒组成与结构,映射关系存在噪声且依赖输入,属于异方差回归问题。在有限且高成本的标注预算下,核心挑战是如何选择待测量或模拟的样本。尽管主动学习是自然方案,但多数采集策略依赖预测不确定性;在异方差噪声下,该信号混淆了可减少的认知不确定性与不可减少的随机不确定性,导致标注预算浪费在噪声主导区域。为此,我们提出自信感知主动学习框架(CAAL),包含两个组件:解耦的不确定性感知训练目标,分别优化预测均值与噪声水平以稳定不确定性估计;以及自信感知采集函数,利用预测的随机不确定性作为可靠性信号,动态加权认知不确定性。在粒子解析数值模拟与真实大气观测上的实验表明,CAAL持续优于标准主动学习基线。该框架为高效扩展高成本大气颗粒物属性数据库提供了实用且通用的解决方案。
原文摘要 · Abstract (English)
Quantifying the impacts of air pollution on health and climate relies on key atmospheric particle properties such as toxicity and hygroscopicity. However, these properties typically require complex observational techniques or expensive particle-resolved numerical simulations, limiting the availability of labeled data. We therefore estimate these hard-to-measure particle properties from routinely available observations (e.g., air pollutant concentrations and meteorological conditions). Because routine observations only indirectly reflect particle composition and structure, the mapping from routine observations to particle properties is noisy and input-dependent, yielding a heteroscedastic regression setting. With a limited and costly labeling budget, the central challenge is to select which samples to measure or simulate. While active learning is a natural approach, most acquisition strategies rely on predictive uncertainty. Under heteroscedastic noise, this signal conflates reducible epistemic uncertainty with irreducible aleatoric uncertainty, causing limited budgets to be wasted in noise-dominated regions. To address this challenge, we propose a confidence-aware active learning framework (CAAL) for efficient and robust sample selection in heteroscedastic settings. CAAL consists of two components: a decoupled uncertainty-aware training objective that separately optimises the predictive mean and noise level to stabilise uncertainty estimation, and a confidence-aware acquisition function that dynamically weights epistemic uncertainty using predicted aleatoric uncertainty as a reliability signal. Experiments on particle-resolved numerical simulations and real atmospheric observations show that CAAL consistently outperforms standard AL baselines. The proposed framework provides a practical and general solution for the efficient expansion of high-cost atmospheric particle property databases.
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