CN109324016A - A kind of determination method of redried odor type style - Google Patents

A kind of determination method of redried odor type style Download PDF

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Publication number
CN109324016A
CN109324016A CN201811210097.3A CN201811210097A CN109324016A CN 109324016 A CN109324016 A CN 109324016A CN 201811210097 A CN201811210097 A CN 201811210097A CN 109324016 A CN109324016 A CN 109324016A
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sample
odor type
redried
style
spectrum
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CN201811210097.3A
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Inventor
毕鸣
毕一鸣
李石头
廖付
张立立
李永生
何文苗
帖金鑫
郝贤伟
田雨农
吴键
吴继忠
程昌合
夏琛
刘建华
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China Tobacco Zhejiang Industrial Co Ltd
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China Tobacco Zhejiang Industrial Co Ltd
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    • GPHYSICS
    • G01MEASURING; TESTING
    • G01NINVESTIGATING OR ANALYSING MATERIALS BY DETERMINING THEIR CHEMICAL OR PHYSICAL PROPERTIES
    • G01N21/00Investigating or analysing materials by the use of optical means, i.e. using sub-millimetre waves, infrared, visible or ultraviolet light
    • G01N21/17Systems in which incident light is modified in accordance with the properties of the material investigated
    • G01N21/25Colour; Spectral properties, i.e. comparison of effect of material on the light at two or more different wavelengths or wavelength bands
    • G01N21/31Investigating relative effect of material at wavelengths characteristic of specific elements or molecules, e.g. atomic absorption spectrometry
    • G01N21/35Investigating relative effect of material at wavelengths characteristic of specific elements or molecules, e.g. atomic absorption spectrometry using infrared light
    • G01N21/359Investigating relative effect of material at wavelengths characteristic of specific elements or molecules, e.g. atomic absorption spectrometry using infrared light using near infrared light

Abstract

The present invention provides a kind of determination method of redried odor type style, a key point for being different from other methods is, it proposes a kind of method for selecting the typical sample with clear odor type style, can determine modeling sample on the basis of not by artificial calibration (expert smokes panel test).Based on typical sample, the spectrum that can really reflect odor type style is filtered out by feature extraction.It avoids due to the not significant caused subsequent spectral manipulation of sample itself odor type, the improper application of the methods of feature extraction;The present invention establishes the odor type model comprising domestic multiple producing region redrieds and constructs piece cigarette perfume type genre distribution figure by the quantization to piece cigarette perfume type, and to cigarette composition, the practical applications such as leaf group maintenance have certain directive significance.

Description

A kind of determination method of redried odor type style
Technical field
The present invention relates to cigarette composition and tobacco product assessment technique fields.This method is suitable for being redried, provides A kind of determination method of effective piece cigarette perfume type style.
Background technique
Odor type style is to characterize the important indicator of tobacco leaf and cigarette product, and show the important of industrial enterprise's Brand characteristic Index.50-60 age, Chinese scholar propose domestic flue-cured tobacco being divided into Luzhou-flavor, flat-flavor and delicate fragrance type three categories.Later, Someone odor type " refinement ", by three original big odor types be refined as delicate fragrance type, it is clear partially in, in partially clear, osculant, in it is partially dense, dense Luzhou-flavor is neutralized partially.However, the judgement of odor type is affected mainly by sensory evaluating smoking by subjective factor, researchers are caused The identification of different producing area odor type is had differences.By natural climate, the influence of planting type etc., between the different years of same producing region Tobacco style also has fluctuation.And basic component units -- the redried of cigarette product, and pass through module formula, redrying, group At increasingly complex compared with single-tobacco-typed cigarette, showing for odor type style is also increasingly complex.Therefore need to seek it is a kind of be detached from suction evaluation, it is objective Decision technology, determine the odor type style of piece cigarette.
Infrared spectroscopy is widely used in industrial circle because its is quick, accurate and lossless.Spectrum multivariate calibration techniques energy Enough it is efficiently used for material component content detection and online process monitoring.Near infrared spectrum is mainly times vibrated to hydric group Frequency and sum of fundamental frequencies absorb, wherein the composition information of most of type organic compounds is contained, with the associated letter of tobacco leaf chemical composition It ceases very rich, therefore redried style is predicted using near infrared spectrum, can objectively reflect each of the year The odor type style of cigarette.Shi Fengcheng etc. using based near infrared spectrum PLS-DA algorithm differentiate the tobacco leaf place of production, to Sichuan, Yunnan, Chongqing, 4, Fujian producing region single-tobacco-typed cigarette establish place of production discrimination model respectively, are greater than to verifying collection sample predictions precision in each producing region 93%.CN201610834599- application discloses a kind of tobacco style similitude classification method based near infrared light spectrum signature, leads to Cross Principal Component Analysis extract spectral signature, then by rows to all near infrared spectrums, obtain data matrix, to its into Row principal component analysis calculates the mean value of principal component by chemometrics method, determines classification line, establishes the region tobacco leaf wind The PCA of lattice distinguishes model, and the substitution for producing region tobacco leaf in short supply provides scientific basis;And its goal of the invention be can be fast and accurately Similitude identification is carried out to the style of tobacco leaf, this method is simple, easily operated, environment friendly and pollution-free.
[Wang Yiding, Zhao Mingqin, Fu Bo wait using the method for visible-near-infrared spectrum identification different flavor style flue-cured tobacco] It discloses to realize the quick discrimination to flue-cured tobacco flavor types style, using visible-near-infrared spectrum technology to Luzhou-flavor, intermediate perfume 3 kinds of type, delicate fragrance type flue-cured tobacco samples carry out spectra collection, obtain the characteristic spectrum information of tobacco leaf intrinsic chemical ingredient.Choose all-wave Section characteristic spectrum is through mean normalization, Savitzky-Golay convolution is smooth, multiplicative scatter correction and standard normal transformation etc. are excellent Change pretreatment, clustering is carried out to spectroscopic data using principal component analysis (PCA), and combine partial least squares discriminant analysis (PLSDA) 3 kinds of odor type style flue-cured tobacco qualitative discrimination models are established.In addition, Shi Fengcheng, Li Dongliang, Feng Guanglin etc. are based on close red The PLS-DA algorithm of external spectrum differentiates the cured tobacco leaf place of production [J] tobacco science and technology.2013 (4) king, one fourth, Zhao Mingqin pay rich equal Using method [J] Chinese Tobacco Science of visible-near-infrared spectrum identification different flavor style flue-cured tobacco, 2015 (6) are all referred to Odor type style is identified by near infrared spectrum.
Above-mentioned technical proposal is analyzed mainly for the place of production, the odor type etc. of single-tobacco-typed cigarette, and odor type sentences in data Surely it smokes panel test by expert.According to majority principle, the odor type of sample is appointed as one of faint scent, intermediate fragrant and giving off a strong fragrance.In fact, The odor type of different tobacco leaves is not independent, and delicate fragrance type tobacco leaf may also have intermediate fragrant or giving off a strong fragrance note.For redried, By formula and beating and double roasting, certain variation is had occurred in the chemical component of piece cigarette, and composition is increasingly complex, and a large amount of piece cigarette does not have Have typical odor type style, even if expert opinion there is also heavy workload and it is at sixes and sevens phenomena such as.
The prior art, which relies on, to be manually specified odor type (label) and is modeled, and does not consider tobacco portion tobacco leaf odor type not allusion quotation The actual conditions of type also lack the method for identifying these tobacco leaf samples.The use of these samples will lead to modeling inaccuracy, reach Less than the effect of application.In addition, the analysis result of the prior art is faint scent, intermediate fragrant or giving off a strong fragrance one kind, cannot reflect not Otherness is shown with odor type between sample, is not able to satisfy purchase evaluation, the practical businesses demand such as formula.
Summary of the invention
The present invention provides a kind of determination method of redried odor type style, and a key point for being different from other methods exists In, propose a kind of method for selecting the typical sample with clear odor type style, it can be by artificial calibration, (expert not be commented Inhale) on the basis of determine modeling sample.Based on typical sample, odor type style can really be reflected by being filtered out by feature extraction Spectrum.It avoids due to the not significant caused subsequent spectral manipulation of sample itself odor type, the methods of feature extraction is no Work as application;The present invention establishes the odor type model comprising domestic multiple producing region redrieds, passes through the quantization to piece cigarette perfume type, structure Piece cigarette perfume type genre distribution figure is built, to cigarette composition, the practical applications such as leaf group maintenance have certain directive significance.
In order to achieve the above-mentioned object of the invention, the present invention provides a kind of determination method of redried odor type style, specific Technical solution are as follows:
A kind of determination method of redried odor type style, includes the following steps:
Step 1) provides K redried sample, its sample spectra is acquired near infrared spectrometer, and to the light of acquisition Spectrum carries out smooth and seeks first derivative processing;
Step 2) carries out first odor type calibration, the mode of odor type calibration are as follows: the tobacco leaf in Yunnan is labeled as to each cigarette sample Faint scent, the place of production are that the tobacco leaf in Hunan, Henan and Anhui is labeled as giving off a strong fragrance, other tobacco leaves are labeled as intermediate fragrant;
Step 3) to piece cigarette sample carry out n times sampling, every time sampling in, in K sample in the piece cigarette of every kind of odor type with Machine extracts the sample of same percentage, forms training set, the sample that do not draw is as test set;Every time after sampling, to training set Model the prediction result of simultaneously labeled test collection sample;Count all samples as forecast set when prediction result, select Typical sample;
Step 4) utilizes typical sample and its corresponding odor type, carries out the Feature Selection in spectrum;
Step 5) establishes odor type Style Model using PLS2;
Step 6) carries out secondary calibration, new modeling of laying equal stress on to modeling sample odor type;
Step 7) acquires the near infrared spectrum of sample to be tested, and the model established using step 6) is to the near-infrared of sample to be tested Spectrum is predicted, determines the odor type style of sample to be tested.
Preferably, the extraction ratio sampled every time in step 3) is the 70%-80% of total sample number, the sample extracted every time Sample accounting of different flavor is consistent with the odor type accounting in original sample in this.
Preferably, the modeling method in step 3) is linear discriminant analysis method, the mark mode of each test sample Correct/error is predicted for odor type.
Preferably, statistical method in step 3) is prediction error rate p, p=prediction error number/be used as test sample Number;Step) in typical sample select mode be p=0 sample.
Preferably, the spectrum characteristic selection mode in step 4) is the difference journey of three kinds of odor types in each spectrum wave number point Degree, is defined as: Sb/Sw;It is different flavor inter _ class relationship matrix for same odor type within class scatter matrix:
Wherein,
X: being indicated training sample, indicated using column vector,
C: indicating C class sample,
μi: indicate the mean value (i=1,2 ..., C) of the i-th class training sample,
Sw: indicating Scatter Matrix in class,
Sb: class scatter matrix is indicated.
Preferably, the modeling method in step 5) is offset minimum binary, wherein X is the spectrum selected after characteristic point, Y For odor type label;Wherein, delicate fragrance type is [1 0 0], and flat-flavor is [0 1 0], and Luzhou-flavor is [0 0 1];Latent variable number by Cross validation error and F, which are examined, to be determined, in the data, model latent variable number is 6.
Preferably, the secondary calibration of the odor type of step 6) is demarcated by the predicted value of training sample in modeling process.
Preferably, the spectrum of sample to be tested and modeling sample carry out identical pretreatment and feature selecting in step 7).
The method of the present invention has a characteristic that 1. by way of stratified sampling-analysis-secondary calibration of statistics-modeling-, Solve the problems, such as that redried sample odor type style is indefinite;2. the sample with typical style is filtered out first, in this base Corresponding Feature Selection and modeling are carried out on plinth, do not find this method in existing method;3. using clear three kinds of dimensions in dense Mode characterizes the odor type style of piece cigarette, more practicability;4. the present invention provides data of smokeing panel test without expert.
Existing method only leans on sensory evaluation to the evaluation of piece cigarette perfume type style, takes time and effort when sample size is big more. By the method for the invention, it realizes the Analysis And Evaluation to the odor type style of sheets used cigarette in formula, is product development, composition maintenance Reference direction is provided.In addition, evaluating piece cigarette processing quality, cigarette of adjusting is evaluated, and the offers references such as tobacco leaf evaluation are expanded in new producing region Opinion.
Detailed description of the invention
Fig. 1 is Technology Roadmap of the invention;
Fig. 2 is sheets used cigarette spectrum in embodiment;
Fig. 3 is the prediction error rate of each sample under multiple sampling;
Fig. 4 is based on the model coefficient figure after typical sample and feature extraction;
Fig. 5 is the odor type distribution map for inventory's piece cigarette that the present invention is calculated.
Specific embodiment
A kind of determination method of redried odor type style, as shown in Figure 1, specifically comprising the following steps:
Step 1) chooses certain business inventory piece cigarette 477, sample, by sample according to tobacco business standard " YC/T after sampling The preparation and determination of moisture Oven Method of 31-1996 tobacco and tobacco product sample " it is prepared into Powder samples and (tobacco leaf is placed in baking oven In, dry 4h at 40 DEG C, with milled 40 mesh of Cyclone mill (FOSS)), spectral measurement, training set sample are carried out after sealing and balancing 1d This spectrogram is as shown in Figure 2;It carries out smooth to the acquisition spectrum in step 1) and seeks first derivative pretreatment, preprocess method It is to eliminate the scattering and other interference in spectrum;
Step 2) carries out first odor type calibration, the mode of odor type calibration are as follows: the tobacco leaf in Yunnan is labeled as to each cigarette sample Faint scent, the place of production are that the tobacco leaf in Hunan, Henan and Anhui is labeled as giving off a strong fragrance, other tobacco leaves are labeled as intermediate fragrant;To different flavor The piece cigarette of tobacco leaf mixing composition, main odor type accounting are labeled as its main odor type, otherwise do not make marks 90% or more, It is not involved in subsequent screening, is only predicted.
Step 3) executes 2000 sampling, randomly selects in 477 samples every time 334 (70%), when extracting every time Guarantee that the position ratio in sample is consistent with original sample collection, LDA modeling, record are carried out to 334 samples and corresponding odor type Remaining 143 sample predictions results;The prediction error rate (with reference to Fig. 3) for counting all samples after sampling 2000 times, is picked out The sample that prediction error rate is 0 is as typical sample;
Step 4) carries out feature extraction to typical sample and corresponding odor type;Spectrum characteristic selection mode is each spectrum wave The difference degree of three kinds of odor types in several points, is defined as: Sb/Sw;For same odor type within class scatter matrix, between different flavor class Scatter matrix:
Wherein,
X: being indicated training sample, indicated using column vector,
C: indicating C class sample,
μi: indicate the mean value (i=1,2 ..., C) of the i-th class training sample,
Sw: indicating Scatter Matrix in class,
Sb: class scatter matrix is indicated.
Step 5) establishes odor type Style Model (with reference to Fig. 4) using PLS2, and modeling method is offset minimum binary, wherein X is Spectrum after selecting characteristic point, Y are odor type label.Wherein, delicate fragrance type is [1 0 0], and flat-flavor is [0 1 0], Luzhou-flavor For [0 0 1].Latent variable number is examined by cross validation error and F and is determined, in the data, model latent variable number is 6;
Odor type is characterized by using three-dimensional label, can more specifically symbolize the odor type difference between different samples, such as It can symbolize based on a typical faint scent sample and a faint scent, the difference of slightly intermediate fragrant sample.In the prior art, two A sample standard deviation is labeled as faint scent, can not show its difference.
Step 6) carries out secondary calibration, new modeling of laying equal stress on to modeling sample odor type;The secondary calibration of odor type is by modeling The predicted value of training sample is demarcated in journey.
The effect of secondary calibration is the part expert opinion disunity removed in primitive modeling sample, the indefinite sample of odor type This, as far as possible improves the precision of data label, to improve the availability of model.
Step 7) obtains spectrum to unknown sample in the same way, and the model established using step 6) is to sample to be tested Near infrared spectrum predicted, determine the odor type style of sample to be tested;The spectrum of sample to be tested is identical as modeling sample carry out Pretreatment and feature selecting.
Sample odor type is given by experience or manually given in the prior art, it is contemplated that the stability that people smokes panel test, The subjective factors such as sensitivity and preference of smokeing panel test in the different human world, so that, always containing the interference of subjective factor, making in subsequent analysis Reliability and the applicability for obtaining result be not strong.
The present invention selects typical sample by multiple sampling, instead of the mode manually demarcated, and people is not necessarily in modeling process Work adjusting parameter, it is as a result more objective.By taking Fig. 5 in embodiment as an example, Shandong (SD) tobacco leaf in evaluation, do not unite by expert opinion One, there is giving off a strong fragrance, it is intermediate fragrant and in partially dense etc. opinions.If pressing existing method, Shandong is demarcated and is built by a certain odor type Mould, result is not inconsistent with other experts necessarily, and is difficult to explain.In the present invention, Shandong tobacco leaf is screened as atypia tobacco leaf, no Participate in modeling.In its prediction result, Shandong tobacco leaf category Luzhou-flavor, but intensity is low compared with Hunan tobacco leaf, and in the whole country, Shandong cigarette Leaf and Yunnan tobacco difference are maximum, and with Hunan, the giving off a strong fragrances tobacco leaf such as Henan also has certain difference.These results obtain most special The approval of family, not only gives odor type, but also reflect difference, more meet practical application.
CN201610834599- application discloses a kind of tobacco style similitude classification side based near infrared light spectrum signature Method extracts spectral signature by Principal Component Analysis, then by rows to all near infrared spectrums, obtains data matrix, Principal component analysis is carried out to it, the mean value of principal component is calculated by chemometrics method, classification line is determined, establishes the region The PCA of tobacco style distinguishes model.This method fails to screen whether model sample has typical odor type feature before modeling, It also fails to characterize in model result and shows otherness between same odor type sample.

Claims (8)

1. a kind of determination method of redried odor type style, includes the following steps:
Step 1) provides K redried sample, acquires its sample spectra near infrared spectrometer, and to the spectrum of acquisition into Row is smooth and seeks first derivative processing;
Step 2) carries out first odor type calibration, the mode of odor type calibration to each cigarette sample are as follows: and the tobacco leaf in Yunnan is labeled as faint scent, The place of production is that the tobacco leaf in Hunan, Henan and Anhui is labeled as giving off a strong fragrance, other tobacco leaves are labeled as intermediate fragrant;
Step 3) carries out n times sampling to piece cigarette sample, every time in sampling, to taking out at random in the piece cigarette of every kind of odor type in K sample The sample of same percentage is taken, forms training set, the sample that do not draw is as test set;Every time after sampling, training set is carried out Model the prediction result of simultaneously labeled test collection sample;Count all samples as forecast set when prediction result, select typical case Sample;
Step 4) utilizes typical sample and its corresponding odor type, carries out the Feature Selection in spectrum;
Step 5) establishes odor type Style Model using PLS2;
Step 6) carries out secondary calibration, new modeling of laying equal stress on to modeling sample odor type;
Step 7) acquires the near infrared spectrum of sample to be tested, and the model established using step 6) is to the near infrared spectrum of sample to be tested It is predicted, determines the odor type style of sample to be tested.
2. a kind of determination method of redried odor type style as described in claim 1, it is characterised in that: in step 3) every time The extraction ratio of sampling is the 70%-80% of total sample number, in the sample extracted every time the sample accounting of different flavor with it is original Odor type accounting in sample is consistent.
3. a kind of determination method of redried odor type style as described in claim 1, it is characterised in that: building in step 3) Mould method is linear discriminant analysis method, and the mark mode of each test sample is that odor type predicts correct/error.
4. a kind of determination method of redried odor type style as described in claim 1, it is characterised in that: the system in step 3) Meter method is the number of prediction error rate p, p=prediction error number/as test sample;It is p=0 that typical sample, which selects mode, Sample.
5. a kind of determination method of redried odor type style as described in claim 1, it is characterised in that: the light in step 4) Spectrum signature selection mode is the difference degree of three kinds of odor types in each spectrum wave number point, is defined as: Sb/Sw;For same odor type class Interior scatter matrix is different flavor inter _ class relationship matrix:
Wherein,
X: being indicated training sample, indicated using column vector,
C: indicating C class sample,
μi: indicate the mean value (i=1,2 ..., C) of the i-th class training sample,
Sw: indicating Scatter Matrix in class,
Sb: class scatter matrix is indicated.
6. a kind of determination method of redried odor type style as described in claim 1, it is characterised in that: building in step 5) Mould method is offset minimum binary, wherein X is the spectrum selected after characteristic point, and Y is odor type label;Wherein, delicate fragrance type is [1 00], flat-flavor is [0 1 0], and Luzhou-flavor is [0 0 1];Latent variable number is examined by cross validation error and F and is determined.
7. a kind of determination method of redried odor type style as described in claim 1, it is characterised in that: the odor type of step 6) Secondary calibration is demarcated by the predicted value of training sample in modeling process.
8. a kind of determination method of redried odor type style as described in claim 1, it is characterised in that: to be measured in step 6) The spectrum and modeling sample of sample carry out identical pretreatment and feature selecting.
CN201811210097.3A 2018-10-17 2018-10-17 A kind of determination method of redried odor type style Pending CN109324016A (en)

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CN110132879A (en) * 2019-06-18 2019-08-16 浙江中烟工业有限责任公司 A kind of flue-cured tobacco note discrimination method based near infrared spectrum
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CN110736718A (en) * 2019-10-16 2020-01-31 浙江中烟工业有限责任公司 Method for identifying producing area and grade of flue-cured tobacco shreds
CN113627647A (en) * 2021-07-08 2021-11-09 广东省农业科学院作物研究所 Tobacco leaf odor type prediction method based on deep learning, electronic equipment and storage medium

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Application publication date: 20190212