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Robust Multivariate Methods in Chemometrics 化学计量学中的稳健多元方法
Comprehensive Chemometrics Pub Date : 2020-06-02 DOI: 10.1016/B978-0-12-409547-2.14642-6
P. Filzmoser, Sven Serneels, R. Maronna, C. Croux
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引用次数: 9
Proficiency Testing in Analytical Chemistry 分析化学能力测试
Comprehensive Chemometrics Pub Date : 1997-12-31 DOI: 10.1039/9781849730709
R. F. Walker, M. Thompson, R. Lawn
{"title":"Proficiency Testing in Analytical Chemistry","authors":"R. F. Walker, M. Thompson, R. Lawn","doi":"10.1039/9781849730709","DOIUrl":"https://doi.org/10.1039/9781849730709","url":null,"abstract":"Proficiency testing is described in sufficient detail for the chemometrician to appreciate how the requirements of analytical chemists have determined the shape of the practice. Aspects of proficiency testing treated in more detail are specifically those requiring a close look at the application of appropriate statistical methods. It is noteworthy that some statistical methods required are well beyond those found in typical degree or masters courses in analytical science. The frequency distributions found in the results of proficiency tests often deviate from the normal and may require inter alia robust methods of estimation, kernel density displays, and mixture modeling to describe them adequately. When a test material is distributed to participants, the portions received have to have the same composition to within narrow limits or comparison of results is meaningless. This calls for tests for instability and heterogeneity, but there are pitfalls for the unwary in these tests, and again obvious methods may not be applicable in their simple form or may have low statistical power.","PeriodicalId":432809,"journal":{"name":"Comprehensive Chemometrics","volume":"45 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1997-12-31","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"115139951","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 27
Two-Way Data Analysis: Detection of Purest Variables 双向数据分析:最纯粹变量的检测
Comprehensive Chemometrics Pub Date : 1900-01-01 DOI: 10.1016/B978-044452701-1.00048-X
W. Windig
{"title":"Two-Way Data Analysis: Detection of Purest Variables","authors":"W. Windig","doi":"10.1016/B978-044452701-1.00048-X","DOIUrl":"https://doi.org/10.1016/B978-044452701-1.00048-X","url":null,"abstract":"","PeriodicalId":432809,"journal":{"name":"Comprehensive Chemometrics","volume":"68 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"115286667","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 14
Representative Sampling, Data Quality, Validation—A Necessary Trinity in Chemometrics 代表性抽样，数据质量，验证——化学计量学中必不可少的三位一体
Comprehensive Chemometrics Pub Date : 1900-01-01 DOI: 10.1016/b978-0-12-409547-2.14872-3
K. Esbensen, L. P. Julius
{"title":"Representative Sampling, Data Quality, Validation—A Necessary Trinity in Chemometrics","authors":"K. Esbensen, L. P. Julius","doi":"10.1016/b978-0-12-409547-2.14872-3","DOIUrl":"https://doi.org/10.1016/b978-0-12-409547-2.14872-3","url":null,"abstract":"","PeriodicalId":432809,"journal":{"name":"Comprehensive Chemometrics","volume":"104 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"126008931","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
The Essentials on Linear Regression, ANOVA, General Linear and Linear Mixed Models for the Chemist 化学家线性回归、方差分析、一般线性和线性混合模型要点
Comprehensive Chemometrics Pub Date : 1900-01-01 DOI: 10.1016/b978-0-12-409547-2.14579-2
B. Govaerts, B. Francq, R. Marion, Manon Martin, Michel Thiel
{"title":"The Essentials on Linear Regression, ANOVA, General Linear and Linear Mixed Models for the Chemist","authors":"B. Govaerts, B. Francq, R. Marion, Manon Martin, Michel Thiel","doi":"10.1016/b978-0-12-409547-2.14579-2","DOIUrl":"https://doi.org/10.1016/b978-0-12-409547-2.14579-2","url":null,"abstract":"","PeriodicalId":432809,"journal":{"name":"Comprehensive Chemometrics","volume":"45 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"124761564","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 5
Screening Strategies 筛选策略
Comprehensive Chemometrics Pub Date : 1900-01-01 DOI: 10.1016/b978-0-12-409547-2.14755-9
R. Torrijos, R. Phan-Tan-Luu
{"title":"Screening Strategies","authors":"R. Torrijos, R. Phan-Tan-Luu","doi":"10.1016/b978-0-12-409547-2.14755-9","DOIUrl":"https://doi.org/10.1016/b978-0-12-409547-2.14755-9","url":null,"abstract":"","PeriodicalId":432809,"journal":{"name":"Comprehensive Chemometrics","volume":"1 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"128736159","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Variable Shift and Alignment 可变移位和对齐
Comprehensive Chemometrics Pub Date : 1900-01-01 DOI: 10.1016/b978-0-12-409547-2.14886-3
R. Jellema, A. Folch-Fortuny, M. Hendriks
{"title":"Variable Shift and Alignment","authors":"R. Jellema, A. Folch-Fortuny, M. Hendriks","doi":"10.1016/b978-0-12-409547-2.14886-3","DOIUrl":"https://doi.org/10.1016/b978-0-12-409547-2.14886-3","url":null,"abstract":"","PeriodicalId":432809,"journal":{"name":"Comprehensive Chemometrics","volume":"2 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"125252500","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 11
Common Clustering Algorithms 常用聚类算法
Comprehensive Chemometrics Pub Date : 1900-01-01 DOI: 10.1016/B978-044452701-1.00064-8
Ickjai Lee, Jianhua Yang
{"title":"Common Clustering Algorithms","authors":"Ickjai Lee, Jianhua Yang","doi":"10.1016/B978-044452701-1.00064-8","DOIUrl":"https://doi.org/10.1016/B978-044452701-1.00064-8","url":null,"abstract":"","PeriodicalId":432809,"journal":{"name":"Comprehensive Chemometrics","volume":"298 9","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"114087671","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 32
Sequential Optimization Methods 顺序优化方法
Comprehensive Chemometrics Pub Date : 1900-01-01 DOI: 10.1016/B978-044452701-1.00036-3
B. Dejaegher, Y. Heyden
{"title":"Sequential Optimization Methods","authors":"B. Dejaegher, Y. Heyden","doi":"10.1016/B978-044452701-1.00036-3","DOIUrl":"https://doi.org/10.1016/B978-044452701-1.00036-3","url":null,"abstract":"","PeriodicalId":432809,"journal":{"name":"Comprehensive Chemometrics","volume":"78 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"123348877","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 4
Chemoinformatics Chemoinformatics
Comprehensive Chemometrics Pub Date : 1900-01-01 DOI: 10.1016/B978-0-12-409547-2.14327-6
J. Polanski
{"title":"Chemoinformatics","authors":"J. Polanski","doi":"10.1016/B978-0-12-409547-2.14327-6","DOIUrl":"https://doi.org/10.1016/B978-0-12-409547-2.14327-6","url":null,"abstract":"","PeriodicalId":432809,"journal":{"name":"Comprehensive Chemometrics","volume":"11 1","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"1900-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"114608926","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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