{"title":"From optical architectures to actual deployment a review of online process spectroscopy in industrial environments.","authors":"Huanqing Zhuo, Bo Zeng, Yinghao Ning, Luomeng Zhang, Congcong Tian, Qianyuan Yu, Qian Miao","doi":"10.3389/fchem.2026.1914581","DOIUrl":null,"url":null,"abstract":"<p><p>Real-time quantitative analysis of complex matrices (e.g., moisture and multiple components) is a critical bottleneck in modern Process Analytical Chemistry (PAC). While online near- and mid-infrared spectroscopy are widely deployed, achieving high-fidelity measurements in dynamic industrial environments remains highly challenging. Severe matrix effects coupled with industrial multi-stress interferences, including continuous detector window pollution and light source drive voltage fluctuations, often cause significant baseline drift and non-linear spectral distortion, challenging both physical optical limits and traditional linear calibration models. To address these challenges, this review systematically evaluates the optical architectures and analytical boundaries of four mainstream online infrared spectrometers: filter-based, grating dispersion, Fourier Transform Infrared (FTIR), and Acousto-Optic Tunable Filters (AOTF). Crucially, we comprehensively review the evolution of chemometric compensation strategies designed to overcome these complex spectral interferences. By comparing traditional multivariate linear models, such as Partial Least Squares (PLS), with cutting-edge deep learning frameworks, notably 1D Convolutional Neural Networks (1D-CNN), we discuss the potential of AI-driven soft-calibration for robust feature extraction and precise quantitative prediction under extreme operational stresses. We emphasize that the advantages of such approaches are contingent upon data availability, the degree of spectral nonlinearity, and the specific process environment; they are not a universal replacement for conventional models, which remain effective under stable and linear conditions. Furthermore, the synergistic evolution of miniaturized solid-state hardware is discussed. Ultimately, this review provides a robust theoretical framework for selecting analytical instruments and developing advanced, data-driven chemometric methodologies in dynamic environments, while acknowledging the practical constraints and trade-offs involved in real-world deployment.</p>","PeriodicalId":12421,"journal":{"name":"Frontiers in Chemistry","volume":"14 ","pages":"1914581"},"PeriodicalIF":5.3000,"publicationDate":"2026-09-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC13587345/pdf/","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Frontiers in Chemistry","FirstCategoryId":"92","ListUrlMain":"https://doi.org/10.3389/fchem.2026.1914581","RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"2026/1/1 0:00:00","PubModel":"eCollection","JCR":"Q2","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
引用次数: 0
Abstract
Real-time quantitative analysis of complex matrices (e.g., moisture and multiple components) is a critical bottleneck in modern Process Analytical Chemistry (PAC). While online near- and mid-infrared spectroscopy are widely deployed, achieving high-fidelity measurements in dynamic industrial environments remains highly challenging. Severe matrix effects coupled with industrial multi-stress interferences, including continuous detector window pollution and light source drive voltage fluctuations, often cause significant baseline drift and non-linear spectral distortion, challenging both physical optical limits and traditional linear calibration models. To address these challenges, this review systematically evaluates the optical architectures and analytical boundaries of four mainstream online infrared spectrometers: filter-based, grating dispersion, Fourier Transform Infrared (FTIR), and Acousto-Optic Tunable Filters (AOTF). Crucially, we comprehensively review the evolution of chemometric compensation strategies designed to overcome these complex spectral interferences. By comparing traditional multivariate linear models, such as Partial Least Squares (PLS), with cutting-edge deep learning frameworks, notably 1D Convolutional Neural Networks (1D-CNN), we discuss the potential of AI-driven soft-calibration for robust feature extraction and precise quantitative prediction under extreme operational stresses. We emphasize that the advantages of such approaches are contingent upon data availability, the degree of spectral nonlinearity, and the specific process environment; they are not a universal replacement for conventional models, which remain effective under stable and linear conditions. Furthermore, the synergistic evolution of miniaturized solid-state hardware is discussed. Ultimately, this review provides a robust theoretical framework for selecting analytical instruments and developing advanced, data-driven chemometric methodologies in dynamic environments, while acknowledging the practical constraints and trade-offs involved in real-world deployment.
期刊介绍:
Frontiers in Chemistry is a high visiblity and quality journal, publishing rigorously peer-reviewed research across the chemical sciences. Field Chief Editor Steve Suib at the University of Connecticut is supported by an outstanding Editorial Board of international researchers. This multidisciplinary open-access journal is at the forefront of disseminating and communicating scientific knowledge and impactful discoveries to academics, industry leaders and the public worldwide.
Chemistry is a branch of science that is linked to all other main fields of research. The omnipresence of Chemistry is apparent in our everyday lives from the electronic devices that we all use to communicate, to foods we eat, to our health and well-being, to the different forms of energy that we use. While there are many subtopics and specialties of Chemistry, the fundamental link in all these areas is how atoms, ions, and molecules come together and come apart in what some have come to call the “dance of life”.
All specialty sections of Frontiers in Chemistry are open-access with the goal of publishing outstanding research publications, review articles, commentaries, and ideas about various aspects of Chemistry. The past forms of publication often have specific subdisciplines, most commonly of analytical, inorganic, organic and physical chemistries, but these days those lines and boxes are quite blurry and the silos of those disciplines appear to be eroding. Chemistry is important to both fundamental and applied areas of research and manufacturing, and indeed the outlines of academic versus industrial research are also often artificial. Collaborative research across all specialty areas of Chemistry is highly encouraged and supported as we move forward. These are exciting times and the field of Chemistry is an important and significant contributor to our collective knowledge.