Calibration methods for complex second-order data

被引:64
作者
Smilde, AK
Tauler, R
Saurina, J
Bro, R
机构
[1] Univ Amsterdam, Analyt Chem Lab, NL-1018 WV Amsterdam, Netherlands
[2] Univ Barcelona, Dept Analyt Chem, E-08028 Barcelona, Spain
[3] Royal Vet & Agr Univ, Chemometr Grp, DK-1958 Frederiksberg, Denmark
关键词
flow injection analysis; rank deficiency; multivariate curve resolution; PARATUCK2; restricted Tucker3;
D O I
10.1016/S0003-2670(99)00374-8
中图分类号
O65 [分析化学];
学科分类号
070302 ; 081704 ;
摘要
In this paper, different three-way methods are tested for their power and shortcomings to solve complex second-order calibration problems. The generic calibration problem is quantifying for an analyte in the presence of an unknown interferent: a second-order calibration problem. Due to rank restrictions of the data, standard second-order calibration methods like Generalized Rank Annihilation cannot be used to solve the type of complex second-order calibration problems shown in this paper. Different real examples are tested in which it is shown that the three-way methods can, to a certain extent, deal with the complex calibrations. This stresses the fact that all second-order calibration methods should be regarded as three-way methods, and when put in this framework, can be compared with respect to their performance. (C) 1999 Elsevier Science B.V. All rights reserved.
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页码:237 / 251
页数:15
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