Multiway Interval Partial Least Squares for Batch Process Performance Monitoring

The method of interval Partial Least Squares (iPLS) is combined with multiway partial least-squares (MPLS) to allow the building of enhanced statistical process performance monitoring models. A novel algorithm is proposed for segmenting batch duration, or spectral data in applications employing spectroscopy data into several subintervals for which independent PLS models can be constructed. The approach deviates from the method of using subintervals of equal length and the practice of choosing only a subset of these subintervals for prediction and/or monitoring. The proposed approach provides dramatic reduction in the number of subintervals required and subsequently the number of PLS models required to give improved prediction and monitoring performance. The proposed method, MiPLS, is applied to the well-known benchmark fed-batch penicillin production simulator, Pensim, for quality variable prediction and fault detection.

[1]  John F. MacGregor,et al.  Multivariate SPC charts for monitoring batch processes , 1995 .

[2]  S. Wold,et al.  Multi‐way principal components‐and PLS‐analysis , 1987 .

[3]  A. A. Tates,et al.  Monitoring a PVC batch process with multivariate statistical process control charts , 1999 .

[4]  Jingqi Yuan,et al.  Statistical monitoring of fed-batch process using dynamic multiway neighborhood preserving embedding , 2008 .

[5]  Erico M M Flores,et al.  Simultaneous determination of sulphamethoxazole and trimethoprim in powder mixtures by attenuated total reflection-Fourier transform infrared and multivariate calibration. , 2009, Journal of pharmaceutical and biomedical analysis.

[6]  M. Reuss,et al.  A mechanistic model for penicillin production , 2007 .

[7]  Age K. Smilde,et al.  Improved monitoring of batch processes by incorporating external information , 2002 .

[8]  Jie Zhang,et al.  Performance monitoring of processes with multiple operating modes through multiple PLS models , 2006 .

[9]  S. Joe Qin,et al.  Multivariate process monitoring and fault diagnosis by multi-scale PCA , 2002 .

[10]  Julian Morris,et al.  MULTISCALE FAULT DETECTION AND DIAGNOSIS IN FED-BATCH FERMENTATION , 2007 .

[11]  Seongkyu Yoon,et al.  Principal‐component analysis of multiscale data for process monitoring and fault diagnosis , 2004 .

[12]  Gülnur Birol,et al.  A modular simulation package for fed-batch fermentation: penicillin production , 2002 .

[13]  Pierre N. Robillard,et al.  Scheduling with earliest start and due date constraints , 1971 .

[14]  Paul Nomikos,et al.  Detection and diagnosis of abnormal batch operations based on multi-way principal component analysis World Batch Forum, Toronto, May 1996 , 1996 .

[15]  Marco Flôres Ferrão,et al.  Simultaneous determination of quality parameters of biodiesel/diesel blends using HATR-FTIR spectra and PLS, iPLS or siPLS regressions , 2011 .

[16]  J. Macgregor,et al.  Monitoring batch processes using multiway principal component analysis , 1994 .

[17]  A. J. Morris,et al.  Local dynamic partial least squares approaches for the modelling of batch processes , 2008 .

[18]  Quansheng Chen,et al.  Determination of total polyphenols content in green tea using FT-NIR spectroscopy and different PLS algorithms. , 2008, Journal of pharmaceutical and biomedical analysis.

[19]  J.F. MacGregor,et al.  Multi-way PCA applied to an industrial batch process , 1994, Proceedings of 1994 American Control Conference - ACC '94.

[20]  Jiewen Zhao,et al.  Measurement of total flavone content in snow lotus (Saussurea involucrate) using near infrared spectroscopy combined with interval PLS and genetic algorithm. , 2010, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

[21]  Adam Krzyzak,et al.  A Polygonal Line Algorithm for Constructing Principal Curves , 1998, NIPS.

[22]  B. Bakshi Multiscale PCA with application to multivariate statistical process monitoring , 1998 .

[23]  Karlene A. Kosanovich,et al.  Improved Process Understanding Using Multiway Principal Component Analysis , 1996 .

[24]  Theodora Kourti,et al.  Analysis, monitoring and fault diagnosis of batch processes using multiblock and multiway PLS , 1995 .

[25]  In-Beum Lee,et al.  Enhanced process monitoring of fed-batch penicillin cultivation using time-varying and multivariate statistical analysis. , 2004, Journal of biotechnology.

[26]  Alberto Ferrer,et al.  Real-time synchronization of batch trajectories for on-line multivariate statistical process control using Dynamic Time Warping , 2011 .

[27]  C. E. Schlags,et al.  Industrial application of SPC to batch polymerization processes , 2001, Proceedings of the 2001 American Control Conference. (Cat. No.01CH37148).

[28]  Ronei J. Poppi,et al.  Application of mid infrared spectroscopy and iPLS for the quantification of contaminants in lubricating oil , 2005 .

[29]  John F. MacGregor,et al.  Multi-way partial least squares in monitoring batch processes , 1995 .