Evaluation Strategies for Coupled GC-IMS Measurement including the Systematic Use of Parametrized ANN

Abstract

Data evaluation strategies for the novel coupled MCC-IMS sensory system are developed. Mayor attention to the plausibility of applied procedures and the feasibility of automation was paid. Three stages of extraction levels with increasing data reduction are presented for several fields of application. According to suitable extraction levels, real data were tested on various structures of artificial neural networks (ANN) with the result, that the computational levels must still be chosen by expertise, but subsequent processing and training can be fully automated. For the training of larger net- works a method of automated generation of secondary training data is presented which exceeds the quality of previous noise models by far. It is concluded that the combination of MCC-IMS as measuring instrument and ANNs as evalua- tion technique have high potential for industrial use in process monitoring.

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A. Scheinemann, S. Sielemann, J. Walter and T. Doll, "Evaluation Strategies for Coupled GC-IMS Measurement including the Systematic Use of Parametrized ANN," Open Journal of Applied Sciences, Vol. 2 No. 4, 2012, pp. 257-266. doi: 10.4236/ojapps.2012.24038.

Conflicts of Interest

The authors declare no conflicts of interest.

References

[1] G. A. Eiceman, “Ion Mobility Spectrometry,” Taylor and Francis Group, London, 2005. doi:10.1201/9781420038972
[2] M. Tsvet, “Physical Chemical Studies on Chlorophyll Adsorptions,” Berichte der Deutschen Botanischen Gesellschaft, Vol. 24, 1906, pp. 316-323.
[3] F. W. Cohen and M. J. Karasek, “Plasma Chromatography—A New Dimension for Gas Chromatography and Mass Spectrometry,” Journal of Chromatographic Science, Vol. 8, No. 6, 1970, pp. 330-337.
[4] C. P. Cram and S. N. Chesler, “Coupling of High Speed Plasma Chromatography with Gas Chromatography,” Journal of Chromatographic Science, Vol. 11, No. 8, 1973, pp. 391-401.
[5] B. Bodeker and J. I. Baumbach, “Analytical Description of IMS-Signals,” International Journal for Ion Mobility Spectrometry, Vol. 12, No. 3, 2009, pp. 103-108.
[6] J. Xu and B. W. William, “Monte Carlo Simulation of Ion Transport in Ion Mobility Spectrometry,” International Journal for Ion Mobility Spectrometry, Vol. 11, No. 1-4, 2008, pp. 13-17.
[7] J. I. Baumbach, S. Sielemann and P. Pilzecker, “Coupling of Multi-Capillary Columns with Two Dierent Types of Ion Mobility Spectrometer,” International Journal for Ion Mobility Spectrometry, Vol. 402, No. 1, 2012, pp. 489-498.
[8] C. L. P. Thomas, “Sensitivity and Resolution in Gas Chromatography-Ion Mobility Spectrometry,” International Journal for Ion Mobility Spectrometry, Vol. 4, No. 2, 2001, pp. 62-68.
[9] Z. Xie, S. Sielemann, H. Schmidt and J. I. Baumbach, “A Novel Method for the Detection of MTBE: Ion Mobility Spectrometry Coupled to Multi Capillary Column,” International Journal for Ion Mobility Spectrometry, Vol. 4, No. 1, 2000, pp. 77-86.
[10] R. Rojas, “Neural Networks,” Springer, Berlin, Heidelberg, 1996.
[11] R. L. Harvey, “Neural Network Principles,” Prentice-Hall International, Upper Saddle River, 1994.
[12] F. Gerald, “Curves and Surfaces for Computer-Aided Geometric Design,” 4th Edition, Elsevier Science and Technology Books, Amsterdam, 1997.
[13] D. Lasser, “Bernstein-Bezier Representation of Volumes,” Computer Aided Geometric Design, Vol. 2, No. 1-3, 1985, pp. 145-149.

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