Yi Liu , Jiefei Gao , Jianwen Shao , Jian Wu , Mingwei Jia , Qiao Liu
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引用次数: 0
Abstract
Handling missing process data is a basic requirement for soft sensor development in process systems engineering. In strongly dynamic and nonlinear operations, imputers that ignore information carried by key performance indicators often yield biased completions and deteriorate soft sensing performance. To address this issue, a transformer-based sequence-to-sequence model (Trans-S2S) is proposed that performs imputation and prediction jointly within an end-to-end framework. The self-attention mechanism can directly model long-term dependencies at different times and is less sensitive to missing values. A long short-term memory then imputes missing values while capturing short-term nonlinearity. For the prediction, a long short-term memory is used to predict key performance indicators from the completed data. Both modules are trained jointly, allowing the soft sensing task to guide imputation. Across missing rate scenarios, Trans-S2S reduces soft sensing errors by 22.41 %–63.75 % on the penicillin fermentation benchmark and by 4.76 %–30.00 % on the cement production dataset, compared with baseline methods. Explanation analysis on the penicillin case further indicates that the imputations remain context-consistent and agree with known process mechanisms.
期刊介绍:
Chemometrics and Intelligent Laboratory Systems publishes original research papers, short communications, reviews, tutorials and Original Software Publications reporting on development of novel statistical, mathematical, or computer techniques in Chemistry and related disciplines.
Chemometrics is the chemical discipline that uses mathematical and statistical methods to design or select optimal procedures and experiments, and to provide maximum chemical information by analysing chemical data.
The journal deals with the following topics:
1) Development of new statistical, mathematical and chemometrical methods for Chemistry and related fields (Environmental Chemistry, Biochemistry, Toxicology, System Biology, -Omics, etc.)
2) Novel applications of chemometrics to all branches of Chemistry and related fields (typical domains of interest are: process data analysis, experimental design, data mining, signal processing, supervised modelling, decision making, robust statistics, mixture analysis, multivariate calibration etc.) Routine applications of established chemometrical techniques will not be considered.
3) Development of new software that provides novel tools or truly advances the use of chemometrical methods.
4) Well characterized data sets to test performance for the new methods and software.
The journal complies with International Committee of Medical Journal Editors'' Uniform requirements for manuscripts.