用二分类器学习随机过程随时间变化的概率密度分布
Time-dependent density estimation using binary classifiers
- 设计时变二分类器,通过对比相邻时刻样本区分分布变化
- 能精确重建复杂多模态、近退化及高维时变密度,支持稀有事件检测
- 适合需要显式概率密度建模的场景,如异常检测与生成采样
我们提出一种数据驱动方法,从样本路径中学习多变量随机过程的时变概率密度,假设初始密度已知且可计算。该方法使用基于对比估计的目标训练一个时变二分类器,使其能够区分随机过程在两个邻近时间点的真实实现。值得注意的是,所提方法显式建模时变概率分布,可在关注的时间范围内获得密度值。此外,分类器输入在最终激活前是密度对数关于时间的二阶近似导数。我们将该方法应用于受随机激励系统的时间依赖概率密度函数近似,并利用其从给定随机向量实现集合成新样本。训练所需的样本路径通过随机插值生成,新样本则使用基于梯度的马尔可夫链蒙特卡洛方法生成,因自动微分可高效提供所需梯度。进一步通过无监督异常检测展示了显式时变密度近似的实用性。多个数值实验表明,该方法能准确重构复杂时变、多模态及近退化密度,有效扩展至中等高维问题,并可靠检测真实数据中的罕见事件。
原文摘要 · Abstract (English)
We propose a data-driven method to learn the time-dependent probability density of a multivariate stochastic process from sample paths, assuming that the initial probability density is known and can be evaluated. Our method uses a novel time-dependent binary classifier trained using a contrastive estimation-based objective that trains the classifier to discriminate between realizations of the stochastic process at two nearby time instants. Significantly, the proposed method explicitly models the time-dependent probability distribution, which means that it is possible to obtain the value of the probability density within the time horizon of interest. Additionally, the input before the final activation in the time-dependent classifier is a second-order approximation to the partial derivative, with respect to time, of the logarithm of the density. We apply the proposed approach to approximate the time-dependent probability density functions for systems driven by stochastic excitations. We also use the proposed approach to synthesize new samples of a random vector from a given set of its realizations. In such applications, we generate sample paths necessary for training using stochastic interpolants. Subsequently, new samples are generated using gradient-based Markov chain Monte Carlo methods because automatic differentiation can efficiently provide the necessary gradient. Further, we demonstrate the utility of an explicit approximation to the time-dependent probability density function through applications in unsupervised outlier detection. Through several numerical experiments, we show that the proposed method accurately reconstructs complex time-dependent, multi-modal, and near-degenerate densities, scales effectively to moderately high-dimensional problems, and reliably detects rare events among real-world data.
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