Prediction of Apple Hybrid Offspring Aroma Based on Hyperspectral

Used Random forest algorithm to construct a prediction model of aroma components based on the hybrid offspring of ‘Honeycrisp’ × ‘Maodi’, and different preprocessing methods were tried (Standardization (SS), First-order Derivative (D1) and Standard normal variate (SNV)). The aroma composition and co...

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Published inFoods Vol. 11; no. 23; p. 3890
Main Authors Zhu, Huili, Wang, Minyan, Zhang, Jing, Ma, Fengwang
Format Journal Article
LanguageEnglish
Published Switzerland MDPI AG 02.12.2022
MDPI
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ISSN2304-8158
2304-8158
DOI10.3390/foods11233890

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Abstract Used Random forest algorithm to construct a prediction model of aroma components based on the hybrid offspring of ‘Honeycrisp’ × ‘Maodi’, and different preprocessing methods were tried (Standardization (SS), First-order Derivative (D1) and Standard normal variate (SNV)). The aroma composition and content were determined by gas chromatography-mass spectrometry (GC-MS), and the main aroma components of apples were classified according to compound categories, including ester, aldehyde, ketone, alcohol. Taking the chemical groups as the research objects, the characteristic wavelengths were selected by grid search algorithm, and the characteristic wavelength-aroma chemical group model was established, and the same method was used to construct the model for single aroma components. The results show: SNV has the best noise removal effect among the five preprocessing methods. Under the SNV treatment, aroma chemical groups of apples showed a good correlation with the spectrum. The number of characteristic spectra of ester are 413, 493, 512, 551, 592, 600, 721, 727, 729, 733 nm, all in the visible light range. The determination coefficient (R2), the root mean square error (RMSE) and the ratio of the standard deviation values (RPD) of validation were 0.90, 4936.16 and 1.13. The characteristic spectrum of alcohols is 519, 562, 570, 571, 660, 676, 737, 738 nm, the range is close to that of ester. The R2 and RMSE of alcohol validation are 0.92 and 83.21, and RPD is 1.30. The number of characteristic spectra of aldehyde is 20, and the most important band is 1000 nm, which is outside the visible light range. The number of characteristic spectra of ketone is 15, and also has some distribution outside the visible light range. The R2 of aldehyde and ketone validation are 0.84 and 0.86. Except for cyclooctanol, the R2 of single aroma compound prediction model performed poorly. Based on the models, we tried to visualize alcohol, which can roughly represent their distribution on apple. Their distributions all show significant differences in the center and edge of apple, but the results are still rough due to the accuracy of models. In conclusion, the study can preliminarily prove that hyperspectral imaging technology (HSI) can perform non-destructive detection of aroma in apple hybrid offspring.
AbstractList Used Random forest algorithm to construct a prediction model of aroma components based on the hybrid offspring of ‘Honeycrisp’ × ‘Maodi’, and different preprocessing methods were tried (Standardization (SS), First-order Derivative (D1) and Standard normal variate (SNV)). The aroma composition and content were determined by gas chromatography-mass spectrometry (GC-MS), and the main aroma components of apples were classified according to compound categories, including ester, aldehyde, ketone, alcohol. Taking the chemical groups as the research objects, the characteristic wavelengths were selected by grid search algorithm, and the characteristic wavelength-aroma chemical group model was established, and the same method was used to construct the model for single aroma components. The results show: SNV has the best noise removal effect among the five preprocessing methods. Under the SNV treatment, aroma chemical groups of apples showed a good correlation with the spectrum. The number of characteristic spectra of ester are 413, 493, 512, 551, 592, 600, 721, 727, 729, 733 nm, all in the visible light range. The determination coefficient (R2), the root mean square error (RMSE) and the ratio of the standard deviation values (RPD) of validation were 0.90, 4936.16 and 1.13. The characteristic spectrum of alcohols is 519, 562, 570, 571, 660, 676, 737, 738 nm, the range is close to that of ester. The R2 and RMSE of alcohol validation are 0.92 and 83.21, and RPD is 1.30. The number of characteristic spectra of aldehyde is 20, and the most important band is 1000 nm, which is outside the visible light range. The number of characteristic spectra of ketone is 15, and also has some distribution outside the visible light range. The R2 of aldehyde and ketone validation are 0.84 and 0.86. Except for cyclooctanol, the R2 of single aroma compound prediction model performed poorly. Based on the models, we tried to visualize alcohol, which can roughly represent their distribution on apple. Their distributions all show significant differences in the center and edge of apple, but the results are still rough due to the accuracy of models. In conclusion, the study can preliminarily prove that hyperspectral imaging technology (HSI) can perform non-destructive detection of aroma in apple hybrid offspring.
Used Random forest algorithm to construct a prediction model of aroma components based on the hybrid offspring of 'Honeycrisp' × 'Maodi', and different preprocessing methods were tried (Standardization (SS), First-order Derivative (D1) and Standard normal variate (SNV)). The aroma composition and content were determined by gas chromatography-mass spectrometry (GC-MS), and the main aroma components of apples were classified according to compound categories, including ester, aldehyde, ketone, alcohol. Taking the chemical groups as the research objects, the characteristic wavelengths were selected by grid search algorithm, and the characteristic wavelength-aroma chemical group model was established, and the same method was used to construct the model for single aroma components. The results show: SNV has the best noise removal effect among the five preprocessing methods. Under the SNV treatment, aroma chemical groups of apples showed a good correlation with the spectrum. The number of characteristic spectra of ester are 413, 493, 512, 551, 592, 600, 721, 727, 729, 733 nm, all in the visible light range. The determination coefficient (R2), the root mean square error (RMSE) and the ratio of the standard deviation values (RPD) of validation were 0.90, 4936.16 and 1.13. The characteristic spectrum of alcohols is 519, 562, 570, 571, 660, 676, 737, 738 nm, the range is close to that of ester. The R2 and RMSE of alcohol validation are 0.92 and 83.21, and RPD is 1.30. The number of characteristic spectra of aldehyde is 20, and the most important band is 1000 nm, which is outside the visible light range. The number of characteristic spectra of ketone is 15, and also has some distribution outside the visible light range. The R2 of aldehyde and ketone validation are 0.84 and 0.86. Except for cyclooctanol, the R2 of single aroma compound prediction model performed poorly. Based on the models, we tried to visualize alcohol, which can roughly represent their distribution on apple. Their distributions all show significant differences in the center and edge of apple, but the results are still rough due to the accuracy of models. In conclusion, the study can preliminarily prove that hyperspectral imaging technology (HSI) can perform non-destructive detection of aroma in apple hybrid offspring.Used Random forest algorithm to construct a prediction model of aroma components based on the hybrid offspring of 'Honeycrisp' × 'Maodi', and different preprocessing methods were tried (Standardization (SS), First-order Derivative (D1) and Standard normal variate (SNV)). The aroma composition and content were determined by gas chromatography-mass spectrometry (GC-MS), and the main aroma components of apples were classified according to compound categories, including ester, aldehyde, ketone, alcohol. Taking the chemical groups as the research objects, the characteristic wavelengths were selected by grid search algorithm, and the characteristic wavelength-aroma chemical group model was established, and the same method was used to construct the model for single aroma components. The results show: SNV has the best noise removal effect among the five preprocessing methods. Under the SNV treatment, aroma chemical groups of apples showed a good correlation with the spectrum. The number of characteristic spectra of ester are 413, 493, 512, 551, 592, 600, 721, 727, 729, 733 nm, all in the visible light range. The determination coefficient (R2), the root mean square error (RMSE) and the ratio of the standard deviation values (RPD) of validation were 0.90, 4936.16 and 1.13. The characteristic spectrum of alcohols is 519, 562, 570, 571, 660, 676, 737, 738 nm, the range is close to that of ester. The R2 and RMSE of alcohol validation are 0.92 and 83.21, and RPD is 1.30. The number of characteristic spectra of aldehyde is 20, and the most important band is 1000 nm, which is outside the visible light range. The number of characteristic spectra of ketone is 15, and also has some distribution outside the visible light range. The R2 of aldehyde and ketone validation are 0.84 and 0.86. Except for cyclooctanol, the R2 of single aroma compound prediction model performed poorly. Based on the models, we tried to visualize alcohol, which can roughly represent their distribution on apple. Their distributions all show significant differences in the center and edge of apple, but the results are still rough due to the accuracy of models. In conclusion, the study can preliminarily prove that hyperspectral imaging technology (HSI) can perform non-destructive detection of aroma in apple hybrid offspring.
Used Random forest algorithm to construct a prediction model of aroma components based on the hybrid offspring of ‘Honeycrisp’ × ‘Maodi’, and different preprocessing methods were tried (Standardization (SS), First-order Derivative (D1) and Standard normal variate (SNV)). The aroma composition and content were determined by gas chromatography-mass spectrometry (GC-MS), and the main aroma components of apples were classified according to compound categories, including ester, aldehyde, ketone, alcohol. Taking the chemical groups as the research objects, the characteristic wavelengths were selected by grid search algorithm, and the characteristic wavelength-aroma chemical group model was established, and the same method was used to construct the model for single aroma components. The results show: SNV has the best noise removal effect among the five preprocessing methods. Under the SNV treatment, aroma chemical groups of apples showed a good correlation with the spectrum. The number of characteristic spectra of ester are 413, 493, 512, 551, 592, 600, 721, 727, 729, 733 nm, all in the visible light range. The determination coefficient (R[sup.2] ), the root mean square error (RMSE) and the ratio of the standard deviation values (RPD) of validation were 0.90, 4936.16 and 1.13. The characteristic spectrum of alcohols is 519, 562, 570, 571, 660, 676, 737, 738 nm, the range is close to that of ester. The R[sup.2] and RMSE of alcohol validation are 0.92 and 83.21, and RPD is 1.30. The number of characteristic spectra of aldehyde is 20, and the most important band is 1000 nm, which is outside the visible light range. The number of characteristic spectra of ketone is 15, and also has some distribution outside the visible light range. The R[sup.2] of aldehyde and ketone validation are 0.84 and 0.86. Except for cyclooctanol, the R[sup.2] of single aroma compound prediction model performed poorly. Based on the models, we tried to visualize alcohol, which can roughly represent their distribution on apple. Their distributions all show significant differences in the center and edge of apple, but the results are still rough due to the accuracy of models. In conclusion, the study can preliminarily prove that hyperspectral imaging technology (HSI) can perform non-destructive detection of aroma in apple hybrid offspring.
Audience Academic
Author Ma, Fengwang
Zhang, Jing
Wang, Minyan
Zhu, Huili
AuthorAffiliation State Key Laboratory of Crop Stress Biology for Arid Areas, Shaanxi Key Laboratory of Apple, College of Horticulture, Northwest A&F University, Xianyang 712100, China
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CitedBy_id crossref_primary_10_1016_j_saa_2024_125426
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Issue 23
Keywords apple
random forest algorithm
hybrid offspring
hyperspectral
HSI
Language English
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Snippet Used Random forest algorithm to construct a prediction model of aroma components based on the hybrid offspring of ‘Honeycrisp’ × ‘Maodi’, and different...
Used Random forest algorithm to construct a prediction model of aroma components based on the hybrid offspring of 'Honeycrisp' × 'Maodi', and different...
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SubjectTerms Alcohols
Aldehydes
Algorithms
Apple
Apples
Aroma compounds
Cameras
Cultivars
Food science
Fruits
Gas chromatography
HSI
hybrid offspring
hyperspectral
Hyperspectral imaging
Ketones
Mass spectrometry
Mass spectroscopy
Model accuracy
Offspring
Physiological aspects
Prediction models
Preprocessing
Quality standards
random forest algorithm
Root-mean-square errors
Search algorithms
Software
Spectra
Standardization
Wavelengths
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Title Prediction of Apple Hybrid Offspring Aroma Based on Hyperspectral
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