{"title":"不同掺杂导电聚合物对电子鼻响应主成分的稳态与动态贡献","authors":"Wiem Haj Ammar, Aicha Boujnah, Aimen Boubaker, Adel Kalboussi, Kamal Lmimouni, Sébastien Pecqueur","doi":"10.3390/eng4040141","DOIUrl":null,"url":null,"abstract":"Multivariate data analysis and machine learning classification have become popular tools to extract features without physical models for complex environments recognition. For electronic noses, time sampling over multiple sensing elements must be a fair compromise between a period sufficiently long to output a meaningful information pattern and sufficiently short to minimize training time for practical applications. Particularly when a reactivity’s kinetics differ from the thermodynamics in sensitive materials, finding the best compromise to get the most from the data is not obvious. Here, we investigate the influence of data acquisition to improve or alter data clustering for molecular recognition on a conducting polymer electronic nose. We found out that waiting for sensing elements to reach their steady state is not required for classification, and that reducing data acquisition down to the first dynamical information suffices to recognize molecular gases by principal component analysis with the same materials. Especially for online inference, this study shows that a good sensing array is not an array of good sensors, and that new figures of merit should be defined for sensing hardware using machine learning pattern recognition rather than metrology.","PeriodicalId":10630,"journal":{"name":"Comput. Chem. Eng.","volume":"62 1","pages":"0"},"PeriodicalIF":0.0000,"publicationDate":"2023-09-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Steady vs. Dynamic Contributions of Different Doped Conducting Polymers in the Principal Components of an Electronic Nose’s Response\",\"authors\":\"Wiem Haj Ammar, Aicha Boujnah, Aimen Boubaker, Adel Kalboussi, Kamal Lmimouni, Sébastien Pecqueur\",\"doi\":\"10.3390/eng4040141\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Multivariate data analysis and machine learning classification have become popular tools to extract features without physical models for complex environments recognition. For electronic noses, time sampling over multiple sensing elements must be a fair compromise between a period sufficiently long to output a meaningful information pattern and sufficiently short to minimize training time for practical applications. Particularly when a reactivity’s kinetics differ from the thermodynamics in sensitive materials, finding the best compromise to get the most from the data is not obvious. Here, we investigate the influence of data acquisition to improve or alter data clustering for molecular recognition on a conducting polymer electronic nose. We found out that waiting for sensing elements to reach their steady state is not required for classification, and that reducing data acquisition down to the first dynamical information suffices to recognize molecular gases by principal component analysis with the same materials. Especially for online inference, this study shows that a good sensing array is not an array of good sensors, and that new figures of merit should be defined for sensing hardware using machine learning pattern recognition rather than metrology.\",\"PeriodicalId\":10630,\"journal\":{\"name\":\"Comput. Chem. Eng.\",\"volume\":\"62 1\",\"pages\":\"0\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2023-09-22\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Comput. Chem. Eng.\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.3390/eng4040141\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Comput. Chem. Eng.","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.3390/eng4040141","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
Steady vs. Dynamic Contributions of Different Doped Conducting Polymers in the Principal Components of an Electronic Nose’s Response
Multivariate data analysis and machine learning classification have become popular tools to extract features without physical models for complex environments recognition. For electronic noses, time sampling over multiple sensing elements must be a fair compromise between a period sufficiently long to output a meaningful information pattern and sufficiently short to minimize training time for practical applications. Particularly when a reactivity’s kinetics differ from the thermodynamics in sensitive materials, finding the best compromise to get the most from the data is not obvious. Here, we investigate the influence of data acquisition to improve or alter data clustering for molecular recognition on a conducting polymer electronic nose. We found out that waiting for sensing elements to reach their steady state is not required for classification, and that reducing data acquisition down to the first dynamical information suffices to recognize molecular gases by principal component analysis with the same materials. Especially for online inference, this study shows that a good sensing array is not an array of good sensors, and that new figures of merit should be defined for sensing hardware using machine learning pattern recognition rather than metrology.