Pattern analysis techniques to process fermentation curves: Application to discrimination of enological alcoholic fermentations

In fermentation processes, kinetic curves are generally aimed at control purposes. However, these curves could also contain information about inherent features of the product (such as origin, quality, etc.). This article presents several pattern analysis techniques used to classify fermentation curves. An application to alcoholic fermentation is presented as an illustration: it aims at retrieving the origin of a must from its fermentation curve. The fermentation kinetics of five vineyard musts, harvested over 9 years on the same parcels, were recorded. From these curves two sets of variables were generated: The first (p1) gathers all the kinetic curve points. The second (p2) contains a restrained number of variables, generated by the expert knowledge of the enologist. The set p2 was processed by two very different techniques: a linear one (factorial discriminant analysis) and a nonlinear one (artificial neural networks). The set p1 was processed by a new chemometric technique, the discriminant partial least‐squares regression. For all the sets and the techniques used the selection of variables was studied. The interest in the latter is largely demonstrated both by theoretical and practical discussions. The discrimination results (up to 94% of good predictions) enhance the interest of the on‐line measurements and their use in such pattern analysis tools. © 2002 Wiley Periodicals, Inc. Biotechnol Bioeng 79: 804–815, 2002.

[1]  Stephen P. Boyd,et al.  Characterisation of citrus by chromatographic analysis of flavonoids , 1997 .

[2]  G Goma,et al.  Alcoholic fermentation: Modelling based on sole substrate and product measurement , 1984, Biotechnology and bioengineering.

[3]  B K Lavine,et al.  Source identification of underground fuel spills by solid-phase microextraction/high-resolution gas chromatography/genetic algorithms. , 2000, Analytical chemistry.

[4]  Y. Woo,et al.  Discrimination of herbal medicines according to geographical origin with near infrared reflectance spectroscopy and pattern recognition techniques. , 1999, Journal of pharmaceutical and biomedical analysis.

[5]  Berndt Müller,et al.  Neural networks: an introduction , 1990 .

[6]  D. Wienke,et al.  Optimal Wavelength Range Selection by a Genetic Algorithm for Discrimination Purposes in Spectroscopic Infrared Imaging , 1997 .

[7]  Antonella Macagnano,et al.  Use of electronic nose and trained sensory panel in the evaluation of tomato quality , 2000 .

[8]  J. Gower Méthodes et programmes d'analyse discriminante , 1975 .

[9]  Optimisation des capteurs d'arômes et fusion multisensorielle appliquée à la caractérisation des produits agro-alimentaires , 1998 .

[10]  S. Wold Cross-Validatory Estimation of the Number of Components in Factor and Principal Components Models , 1978 .

[11]  Jean-Marie Sablayrolles,et al.  Alcoholic fermentation under oenological conditions , 1995 .

[12]  F. Radler,et al.  Possible Use of Nisin in Winemaking. I. Action of Nisin Against Lactic Acid Bacteria and Wine Yeasts in Solid and Liquid Media , 1990, American Journal of Enology and Viticulture.

[13]  Steven D. Brown,et al.  Application of New Variable Selection Techniques to near Infrared Spectroscopy , 1996 .

[14]  J. Nault,et al.  Species Differentiation of Two Common Lumber Mixes by Diffuse Reflectance Fourier Transform Infrared (DRIFT) Spectroscopy , 1997 .

[15]  F. Winquist,et al.  Electronic nose for microbial quality classification of grains. , 1997, International journal of food microbiology.

[16]  Jules Thibault,et al.  Comparison of prediction performances between models obtained by the group method of data handling and neural networks for the alcoholic fermentation rate in enology , 1991 .

[17]  J. C. Mason,et al.  Selection of neural network structures : some approximation theory guidelines , 1995 .

[18]  Christopher M. Bishop,et al.  Neural networks for pattern recognition , 1995 .

[19]  W. J. Harper,et al.  PATTERN RECOGNITION OF SWISS CHEESE AROMA COMPOUNDS BY SPME/GC AND AN ELECTRONIC NOSE , 1998 .

[20]  Jean-Marie Sablayrolles,et al.  Kinetics of Alcoholic Fermentation Under Anisothermal Conditions. II. Prediction From the Kinetics Under Isothermal Conditions , 1993 .

[21]  Ma Remedios Marín,et al.  Alcoholic Fermentation Modelling: Current State and Perspectives , 1999, American Journal of Enology and Viticulture.

[22]  J. J. Ibarrola,et al.  A new fuzzy control system for white wine fermentation , 1999 .

[23]  Peter J. Gawthrop,et al.  Neural networks for control systems - A survey , 1992, Autom..

[24]  B. Upchurch,et al.  Pattern recognition models for spectral reflectance evaluation of apple blemishes , 1998 .

[25]  J. C. D. Silva Procedure for the Classification of Fulvic Acids and Similar Substances Based on the Variation With pH of Their Synchronous Fluorescence Spectra , 1997 .

[26]  R. Schudy,et al.  Neural network pattern recognition of photoacoustic FTIR spectra and knowledge-based techniques for detection of mycotoxigenic fungi in food grains. , 1998, Journal of Food Protection.

[27]  Jean-Marie Sablayrolles,et al.  Automatic detection of assimilable nitrogen deficiencies during alcoholic fermentation in oenological conditions , 1990 .

[28]  R. Leardi Application of a genetic algorithm to feature selection under full validation conditions and to outlier detection , 1994 .

[29]  A. Cheruy,et al.  Method for On-Line Prediction of Kinetics of Alcoholic Fermentation in Wine Making , 1989 .

[30]  J. H. Kim,et al.  Gas chromatographic amino acid profiling of wine samples for pattern recognition. , 1996, Journal of chromatography. A.

[31]  Jean-Marie Sablayrolles,et al.  Design of a laboratory automatic system for studying alcoholic fermentations in anisothermal enological conditions. , 1987 .

[32]  Michael J. McShane,et al.  Variable Selection in Multivariate Calibration of a Spectroscopic Glucose Sensor , 1997 .

[33]  Douglas N. Rutledge,et al.  GENETIC ALGORITHM APPLIED TO THE SELECTION OF PRINCIPAL COMPONENTS , 1998 .