Abstract
Following the discovery of the least squares method in 1805 by Legendre and later in 1809 by Gauss, surrogate modeling and machine learning have come a long way. From identifying patterns and trends in process data to predictive modeling, optimization, fault detection, reaction network discovery, and process operations, machine learning became an integral part of all aspects of process design and process systems engineering. This is enabled, at the same time necessitated, by the vast amounts of data that are readily available from processes, increased digitalization, automation, increasing computation power, and simulation software that can model complex phenomena that span over several temporal and spatial scales. Although this paper is not a comprehensive review, it gives an overview of the recent history of machine learning models that we use every day and how they shaped process design problems from the recent advances to the exploration of their prospects.