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THE IMPACT OF THE SPECTRA DISTORTIONS ON THE TRUENESS OF THE QUANTITATIVE ANALYSIS IN MULTIVARIATE CALIBRATION

Abstract

Computer-based evaluation of the trueness of the quantitative analysis of the multicomponent mixtures using multivariate calibration has been performed in the case of the disturbed spectra of the training set. The permissible limits of these distortions have been established.

About the Authors

Iosif Mikhailovich Dubrovkin
Western Galilee Academic College
Russian Federation


Vladimir Alekseevich Ananiev
KemSU
Russian Federation


References

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Review

For citations:


Dubrovkin I.M., Ananiev V.A. THE IMPACT OF THE SPECTRA DISTORTIONS ON THE TRUENESS OF THE QUANTITATIVE ANALYSIS IN MULTIVARIATE CALIBRATION. The Bulletin of Kemerovo State University. 2012;(2):186-191. (In Russ.)

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ISSN 2949-2122 (Print)
ISSN 2949-2092 (Online)