A. Guiberteau , T. Galeano , N. Mora , F. Salinas , J.M. Ortı́z , J.C. Viré
{"title":"利用PLS校准和人工神经网络,用极谱技术对队长、队长醇和队长醇的三元混合物进行分辨","authors":"A. Guiberteau , T. Galeano , N. Mora , F. Salinas , J.M. Ortı́z , J.C. Viré","doi":"10.1016/S0097-8485(00)00109-1","DOIUrl":null,"url":null,"abstract":"<div><p>The simultaneous polarographic determination of the ternary mixture of captan-captafol and folpet is studied. The polarographic signals of these compounds in their mixture show a high overlapping. For this reason different chemometric methods such as PLS, PCR and artificial neuronal network (ANN) have been utilized for the simultaneous determination of these compounds in mixtures. The calibration model is built from solutions containing river water of known pesticide concentrations and the signals obtained by Sampled DC and DPP (differential pulse polarography) have been used. The analysis of both synthetic and real samples (river water) has been carried out by PLS with satisfactory results in most cases. It is possible to determine 0.25 ppm of each pesticide in river water samples after a preconcentration step by extraction into diethyl ether. ANN has also been applied to improve the results obtained by the PLS tool when the sampled DC current is recorded or when liquid–solid extraction with C<sub>18</sub> cartridges is performed.</p></div>","PeriodicalId":79331,"journal":{"name":"Computers & chemistry","volume":"25 5","pages":"Pages 459-473"},"PeriodicalIF":0.0000,"publicationDate":"2001-09-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/S0097-8485(00)00109-1","citationCount":"13","resultStr":"{\"title\":\"Resolution by polarographic techniques of the ternary mixture of captan, captafol and folpet by using PLS calibration and artificial neuronal networks\",\"authors\":\"A. Guiberteau , T. Galeano , N. Mora , F. Salinas , J.M. Ortı́z , J.C. Viré\",\"doi\":\"10.1016/S0097-8485(00)00109-1\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>The simultaneous polarographic determination of the ternary mixture of captan-captafol and folpet is studied. The polarographic signals of these compounds in their mixture show a high overlapping. For this reason different chemometric methods such as PLS, PCR and artificial neuronal network (ANN) have been utilized for the simultaneous determination of these compounds in mixtures. The calibration model is built from solutions containing river water of known pesticide concentrations and the signals obtained by Sampled DC and DPP (differential pulse polarography) have been used. The analysis of both synthetic and real samples (river water) has been carried out by PLS with satisfactory results in most cases. It is possible to determine 0.25 ppm of each pesticide in river water samples after a preconcentration step by extraction into diethyl ether. ANN has also been applied to improve the results obtained by the PLS tool when the sampled DC current is recorded or when liquid–solid extraction with C<sub>18</sub> cartridges is performed.</p></div>\",\"PeriodicalId\":79331,\"journal\":{\"name\":\"Computers & chemistry\",\"volume\":\"25 5\",\"pages\":\"Pages 459-473\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2001-09-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://sci-hub-pdf.com/10.1016/S0097-8485(00)00109-1\",\"citationCount\":\"13\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Computers & chemistry\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0097848500001091\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Computers & chemistry","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0097848500001091","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
Resolution by polarographic techniques of the ternary mixture of captan, captafol and folpet by using PLS calibration and artificial neuronal networks
The simultaneous polarographic determination of the ternary mixture of captan-captafol and folpet is studied. The polarographic signals of these compounds in their mixture show a high overlapping. For this reason different chemometric methods such as PLS, PCR and artificial neuronal network (ANN) have been utilized for the simultaneous determination of these compounds in mixtures. The calibration model is built from solutions containing river water of known pesticide concentrations and the signals obtained by Sampled DC and DPP (differential pulse polarography) have been used. The analysis of both synthetic and real samples (river water) has been carried out by PLS with satisfactory results in most cases. It is possible to determine 0.25 ppm of each pesticide in river water samples after a preconcentration step by extraction into diethyl ether. ANN has also been applied to improve the results obtained by the PLS tool when the sampled DC current is recorded or when liquid–solid extraction with C18 cartridges is performed.