公开119组化工批式精馏实验数据,助力机器学习异常检测模型研发。
Batch Distillation Data for Developing Machine Learning Anomaly Detection Methods
- 构建实验室级批式精馏装置,采集含异常与正常工况的多源时序数据。
- 包含119组实验,每组异常数据均配对正常实验,支持对比分析。
- 适合从事工业异常检测、可解释性机器学习的研究者使用。
机器学习在化工过程异常检测中潜力巨大,但受限于缺乏公开实验数据。为此,我们搭建了实验室级批式精馏装置,在多种操作条件和混合物下开展119组实验,涵盖正常与人为引入异常的情况。多数异常实验均配有对应的正常实验。数据集包含大量传感器与执行器的时序数据,以及测量不确定度估计;还提供在线台式NMR浓度谱、视频与音频等非常规数据源。所有实验均附有详细元数据与专家标注,异常分类基于本研究构建的本体。数据以结构化形式组织,通过doi.org/10.5281/zenodo.17395543 免费开放。该数据集不仅支持先进机器学习异常检测方法开发,更因包含异常成因信息,有助于可解释、可追溯及异常缓解方法的研究。
原文摘要 · Abstract (English)
Machine learning (ML) holds great potential to advance anomaly detection (AD) in chemical processes. However, the development of ML-based methods is hindered by the lack of openly available experimental data. To address this gap, we have set up a laboratory-scale batch distillation plant and operated it to generate an extensive experimental database, covering fault-free experiments and experiments in which anomalies were intentionally induced, for training advanced ML-based AD methods. In total, 119 experiments were conducted across a wide range of operating conditions and mixtures. Most experiments containing anomalies were paired with a corresponding fault-free one. The database that we provide here includes time-series data from numerous sensors and actuators, along with estimates of measurement uncertainty. In addition, unconventional data sources -- such as concentration profiles obtained via online benchtop NMR spectroscopy and video and audio recordings -- are provided. Extensive metadata and expert annotations of all experiments are included. The anomaly annotations are based on an ontology developed in this work. The data are organized in a structured database and made freely available via doi.org/10.5281/zenodo.17395543. This new database paves the way for the development of advanced ML-based AD methods. As it includes information on the causes of anomalies, it further enables the development of interpretable and explainable ML approaches, as well as methods for anomaly mitigation.
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