Spectroscopy and Chemometrics/Machine-Learning News Weekly #48, 2021

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Spectroscopy and Chemometrics News Weekly 47, 2021 | NIRS NIR Spectroscopy MachineLearning Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software IoT Sensors QA QC Testing Quality LINK

Spektroskopie und Chemometrie Neuigkeiten Wöchentlich 47, 2021 | NIRS NIR Spektroskopie MachineLearning Spektrometer IoT Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse LINK

Spettroscopia e Chemiometria Weekly News 47, 2021 | NIRS NIR Spettroscopia MachineLearning analisi chimica Spettrale Spettrometro Chem IoT Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem QualityControl LINK

This week’s NIR news Weekly is sponsored by Your-Company-Name-Here – NIR-spectrometers. Check out their product page … link

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Near-Infrared Spectroscopy (NIRS)

“Integrative Computational Analysis of Muscle Near-Infrared Spectroscopy Signals: Effects of Oxygen Delivery and Blood Volume” LINK

“Near Infrared Spectroscopic Evaluation of Starch Properties of Diverse Sorghum Populations” LINK

“Non-Destructive Prediction of Paddy Seed Quality using Near Infrared Spectroscopy” LINK

“Orthogonal Signal Correction of Near-Infrared Spectra for the Prediction of Glucose in Human Tissue” LINK

“Joint calibration of soil Vis-NIR spectra across instruments, soil types & properties by attention-based spectra encoding-spectra/property decoding architecture” LINK

“Determining the Influence of Sample Preparation and Feed Form on the Predictability of the Near Infrared Reflectance Spectroscopy Technique” LINK

“Non-invasive Blood Glucose Detection Sensor System Based on Near-Infrared Spectroscopy” LINK

“Minerals : Salinity Monitoring at Saline Sites with VisibleNear-Infrared Spectral Data” LINK

“平均分布差异最小化的 NIR 标定迁移方法研究” LINK

“Effectiveness of visible – Near infrared spectroscopy coupled with simulated annealing partial least squares analysis to predict immunoglobulins G, A, and M concentration in bovine colostrum” LINK

“PSV-15 Using near infrared reflectance spectroscopy to predict lab scoured yield in Rambouillet sheep” | LINK

“Effective prediction of soil organic matter by deep SVD concatenation using FT-NIR spectroscopy” LINK

“Study on the identification of resistance of rice blast based on near infrared spectroscopy” LINK

“Predicting Organic Matter Content, Total Nitrogen and pH Value of Lime Concretion Black Soil Based on Visible and Near Infrared Spectroscopy” |(2011)43 LINK

“Application of near-infrared spectroscopy in detection of steroids adulteration in traditional Thai medicines” LINK

“Development of a new NIR-machine learning approach for simultaneous detection of diesel various properties” LINK




Infrared Spectroscopy (IR) and Near-Infrared Spectroscopy (NIR)

“Near infrared for white wine analysis” LINK

“Microscale Infrared Technologies for Spectral Filtering and Wireless Neural Dust” LINK

“Performance of fieldscale lab vs in situ visible/near and midinfrared spectroscopy for estimation of soil properties” LINK




Raman Spectroscopy

“Detection of SubTerahertz Raman Response and Nonlinear Optical Effects for Luminescent Yb(III) Complexes” LINK




Hyperspectral Imaging (HSI)

“Vis-NIR Hyperspectral Imaging for Online Quality Evaluation during Food Processing: A Case Study of Hot Air Drying of Purple-Speckled Cocoyam (Colocasia …” LINK

” New Approach to the Old Challenge of Free Flap Monitoring—Hyperspectral Imaging Outperforms Clinical Assessment by Earlier Detection of Perfusion Failure” LINK

“Remote Sensing : UAV-Borne Hyperspectral Imaging Remote Sensing System Based on Acousto-Optic Tunable Filter for Water Quality Monitoring” LINK

“4D line-scan hyperspectral imaging” | LINK

“Near-infrared hyperspectral imaging for polymer particle size estimation” LINK

“Foreign Object Detection from Fresh-Cut Vegetables Using Near Infrared Hyperspectral Imaging Techniques” LINK




Chemometrics and Machine Learning

“Neural-network-powered pulse reconstruction from one-dimensional interferometric cross-correlation traces. (arXiv:2111.01014v1 [physics.optics])” LINK

“Spectral reconstruction with model-based neural network for liquid crystal modulator devices” LINK

“Supporting soil and land assessment with machine learning models using the Vis-NIR spectral response” LINK

“Applications of NIR spectroscopy and chemometrics to illicit drug analysis: An example from inhalant drug screening tests” LINK




Optics for Spectroscopy

“Polymers : Composite Materials from Renewable Resources as Sustainable Corrosion Protection Coatings” LINK

“Improvement of the Physical Properties of Electro-spun Polyacrylonitrile Nano-fibers Using the Fe2O3 Nanoparticles for Wastewater Treatment” LINK

“Nanomaterials : Facile and Sensitive Detection of Nitrogen-Containing Organic Bases with Near Infrared C-Dots Derived Assays” LINK




Facts

“On the possible benefits of deep learning for spectral preprocessing” LINK




Research on Spectroscopy

“Data : A Principal Components Analysis-Based Method for the Detection of Cannabis Plants Using Representation Data by Remote Sensing” LINK

“Foods : Inner Properties Estimation of Gala Apple Using Spectral Data and Two Statistical and Artificial Intelligence Based Methods” LINK

“Effects on volatile oil and volatile compounds of Amomum tsao-ko with different pre-drying and drying methods” LINK

“Investigation of innovative analytical techniques and methodological approaches for the analysis of phyto-cannabinoids in cannabis samples” LINK

“A Novel Compression Method of Spectral Data Matrix Based on the Low-Rank Approximation and the Fast Fourier Transform of the Singular Vectors” LINK




Equipment for Spectroscopy

“Feasibility of portable NIR spectrometer for quality assurance in glue-laminated timber production” LINK




Process Control and NIR Sensors

“Applications for remote sensing by unmanned aerial vehicles in reclamation monitoring” LINK

“282 Nutritional Monitoring of Prenatally Stressed and Translocated Brahman Heifers” LINK




Environment NIR-Spectroscopy Application

“Importance of the legacy effect for assessing spatiotemporal correspondence between interannual tree-ring width and remote sensing products in the Sierra …” LINK

“Retrieving zinc concentrations in topsoil with reflectance spectroscopy at Opencast Coal Mine sites” | LINK




Agriculture NIR-Spectroscopy Usage

“Sustainability : Estimation of Heavy Metal(Loid) Contents in Agricultural Soil of the Suzi River Basin Using Optimal Spectral Indices” LINK

“Forage Grasses Steer Soil Nitrogen Processes, Microbial Populations, and Microbiome Composition in A Long-term Tropical Agriculture System” LINK

“Symmetric and asymmetric overgrowth of a Ag shell onto gold nanorods assisted by Pt pre-deposition” | LINK

“Agronomy : Applicability of Near Infrared Reflectance Spectroscopy to Predict Amylose Contents of Single-Grain Maize” LINK

“Nondestructive Detection of Weight Loss Rate, Surface Color, Vitamin C Content, and Firmness in Mini-Chinese Cabbage with Nanopackaging by Fourier Transform …” LINK

“Task Complexity and Image Clarity Facilitate Motor and Visuo-Motor Activities in Mirror Therapy in Post-stroke Patients” | LINK

“Near infrared spectrometry to evaluate the feed value of forages” LINK

“Nondestructive Prediction of Anthocyanin Content of Pigmented Soybean Seeds using Hyperspectral Near-infrared imaging” LINK

“Intravascular imaging beyond ischaemia assessment: a possible way for improving risk stratification” | LINK




Horticulture NIR-Spectroscopy Applications

“Extending the use of fiber optic equipped visible/near infrared reflectance spectrometer to measure peel color of various fruits and vegetables” LINK

“High-Throughput Plant Phenotyping for the Chilling Stress of Watermelon Plants” LINK




Food & Feed Industry NIR Usage

“Quantitative detection of benzoyl peroxide in wheat flour using line-scan short-wave infrared hyperspectral imaging” LINK

“Spectroscopy of Phenolic Antioxidants” | LINK




Pharma Industry NIR Usage

“Beyond the Patient’s Report: Self-Reported, Subjective, Objective and Estimated Walking Disability in Patients with Peripheral Artery Disease” LINK

“Greater plaque burden and cholesterol content may explain an increased incidence of non-culprit events in diabetic patients: a Lipid-Rich Plaque substudy” LINK

“Spatial covariation between solar-induced fluorescence and vegetation indices from Arctic-Boreal landscapes” LINK

“Spectroscopic characteristics of Xeloda chemodrug” LINK




Laboratory and NIR-Spectroscopy

“Particle-specific characterisation of non-hazardous, coarse-shredded mixed waste for real-time quality assurance” LINK




Other

“Facile fabrication of PS-CHO core-shell composite microspheres via in-situ chemical deposition and their photocatalytic application on oxidative degradation …” LINK

“A trace CH<sub>4</sub> detection system based on DAS calibrated WMS technique” LINK

“Denitrification and dissimilatory nitrate reduction to ammonia in long-term lake sediment microcosms with iron (II)” LINK

“近红外光谱的通用聚苯乙烯牌号在线识别方法” LINK

“非均匀固体籽粒近红外光谱采集方法研究” LINK

“基于卷积神经网络和近红外光谱的太平猴魁茶产地鉴别分析” LINK

“鸡腿肌冻干粉蛋氨酸近红外光谱定量预测模型的建立与优化” LINK

“Anthocyanins – Definition, Benefits, Sources” LINK

“Varijabilnost parametara kvalitete zrna hrvatskih i stranih genotipova soje (Glycine max L.)” LINK

“Cultivation and Performance Analysis of Simultaneous Partial Nitrification, ANAMMOX, and Denitratation Granular Sludge” LINK

“CHEMICAL CHARACTERIZATION OF BARK COMPOUNDS FROM CAATINGA SPECIES” LINK



Spectroscopy and Chemometrics/Machine-Learning News Weekly #47, 2021

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Knowledge-Based Variable Selection and Model Selection for near-infrared spectroscopy (NIRS) | PLSR PCA PCR PLS SVM LINK

Spectroscopy and Chemometrics News Weekly 46, 2021 | NIRS NIR Spectroscopy MachineLearning Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software IoT Sensors QA QC Testing Quality LINK

Spektroskopie und Chemometrie Neuigkeiten Wöchentlich 46, 2021 | NIRS NIR Spektroskopie MachineLearning Spektrometer IoT Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse LINK

Spettroscopia e Chemiometria Weekly News 46, 2021 | NIRS NIR Spettroscopia MachineLearning analisi chimica Spettrale Spettrometro Chem IoT Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem QualityControl LINK

This week’s NIR news Weekly is sponsored by Your-Company-Name-Here – NIR-spectrometers. Check out their product page … link

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Near-Infrared Spectroscopy (NIRS)

“At-line quality assurance of deep-fried instant noodles using pilot scale visible-NIR spectroscopy combined with deep-learning algorithms” LINK

“Application of near-infrared spectroscopy technology in the complex fermentation system to achieve high-efficiency production” LINK

“Near-infrared optical spectroscopy for pancreas shrinkage estimation with multi synchrosqueezing transform and multivariate regression model” | LINK

“Translating near-infrared spectroscopy from laboratory to commercial slaughterhouse: existing challenges and solutions” LINK

“Aquaphotomics for Bio-Diagnostics in Dairy : Applications of near-Infrared Spectroscopy.” LINK

“Impact of near infrared (NIR) spectroscopy and hyperspectral (HS) imaging system to predict physicochemical composition and quality attributes of meat: A review” LINK

“Identification of lactic acid bacteria and rhizobacteria by ultraviolet-visible-near infrared spectroscopy and multivariate classification” LINK

“Applied Sciences : Aquaphotomics Reveals Subtle Differences between Natural Mineral, Processed and Aged Water Using Temperature Perturbation Near-Infrared Spectroscopy” LINK

“Comparison of different processing approaches by SVM and RF on HS-MS eNose and NIR Spectrometry data for the discrimination of gasoline samples” LINK

“An Overview of Near Infrared Spectroscopy and Its Applications in the Detection of Genetically Modified Organisms” LINK

“Use of near-infrared spectroscopy with Fourier Transform (FT-NIR) to accompany the Bovine Parasitic Sadness process.” LINK

“Near-infrared Stokes spectropolarimetry as a novel local measurement method of atomic line emission in SOL and divertor plasmas” LINK

“Handheld NIRS for forage evaluation” LINK

“Detection of Profenofos in Chinese Kale, Cabbage, and Chili Spur Pepper Using Fourier Transform Near-Infrared and Fourier Transform Mid-Infrared Spectroscopies” LINK

“Determination of the Geographical Origin of Hazelnuts (Corylus avellana L.) by Near-Infrared Spectroscopy (NIR) and a Low-Level Fusion with Nuclear Magnetic …” LINK

“Foods : On-Line Real-Time Monitoring of a Rapid Enzymatic Oil Degumming Process: A Feasibility Study Using Free-Run Near-Infrared Spectroscopy” LINK

“Determination of Moisture, Fat, Carbohydrates and Protein Contents in Flour by Near Infrared Spectroscopy” LINK




Infrared Spectroscopy (IR) and Near-Infrared Spectroscopy (NIR)

“Nearinfrared optical spectroscopy for pancreas shrinkage estimation with multi synchrosqueezing transform and multivariate regression model” LINK

“Prospector: A mobile application for portable, high‐throughput near‐infrared spectroscopy phenotyping” LINK

“Indandioneterminated quinoidal compounds for lowbandgap small molecules with strong nearinfrared absorption: effect of conjugation length on the properties” LINK

“Chemometric approach to characterization of the selected grape seed oils based on their fatty acids composition and FTIR spectroscopy” LINK

“Heat impact control in flash pasteurization by estimation of applied pasteurization units using near infrared spectroscopy” LINK

“Revealing the interactions of water with cryoprotectant and protein by near− infrared spectroscopy” LINK




Raman Spectroscopy

“Silk fibroin fibers decorated with urchin-like Au/Ag nanoalloys: a flexible hygroscopic SERS sensor for monitoring of folic acid in human sweat” LINK




Hyperspectral Imaging (HSI)

“HyperMixNet: Hyperspectral Image Reconstruction With Deep Mixed Network From a Snapshot Measurement” LINK

“Hyperspectral image classification based on parallel-branch expectation-maximization attention mechanism” LINK

“Applied Sciences : Variety Identification of Chinese Walnuts Using Hyperspectral Imaging Combined with Chemometrics” LINK

“Visualization of heavy metal cadmium in lettuce leaves based on wavelet support vector machine regression model and visiblenear infrared hyperspectral imaging” LINK

“Improving the estimation accuracy of SPAD values for maize leaves by removing UAV hyperspectral image backgrounds” LINK

“Leaf water content estimation using top-of-canopy airborne hyperspectral data” LINK




Terahertz Spectroscopy

“Sensors : Terahertz Imaging for Breast Cancer Detection” LINK




Chemometrics and Machine Learning

“Comparative study of preprocessing on ATRFTIR calibration model for insitu monitoring of solution concentration in cooling crystallization” LINK

“Variable selection for near-infrared spectrum modeling based on fast nondominated sorting genetic algorithm” LINK

“Ripening assessment of ‘Ortanique'(Citrus reticulata Blanco x Citrus sinensis (L) Osbeck) on tree by SW-NIR reflectance spectroscopy-based calibration models” LINK

“Molecules : Quantification of Corn Adulteration in Wet and Dry-Processed Peaberry Ground Roasted Coffees by UVVis Spectroscopy and Chemometrics” LINK

“A best-practice guide to predicting plant traits from leaf-level hyperspectral data using partial least squares regression ” | LINK

“Development of a new approach for a rapid IDENTIfication and CLASSification of uranium powders using colour, image texture and spectroscopy signatures” LINK

“Foods : Electronic Tongue as a Correlative Technique for Modeling Cattle Meat Quality and Classification of Breeds” LINK

“Digital Twin of Low Dosage Continuous Powder Blending – Artificial Neural Networks and Residence Time Distribution Models” LINK




Optics for Spectroscopy

“A new penternary semiconductor Cu2CoSn (SSe) 4 nanocrystal: a study on structural, dielectric and optical properties” | LINK




Research on Spectroscopy

“Polymers : Valorization Strategy for Leather Waste as Filler for High-Density Polyethylene Composites: Analysis of the Thermal Stability, Insulation Properties and Chromium Leaching” LINK

“Multi-method exploration of the relationship between sleep and infant neurocognitive development” LINK

“Opportunities and Limitations of Mobile Neuroimaging Technologies in Educational Neuroscience” LINK

“A Triphenylphosphonium Functionalized AIE Conjugated Macrocyclic Tetramaleimide for Mitochondrialtargeting Bioimaging” LINK




Equipment for Spectroscopy

“Evaluation of MEMS NIR Spectrometers for On-Farm Analysis of Raw Milk Composition” LINK

“Light-induced off-axis cavity-enhanced thermoelastic spectroscopy in the near-infrared for trace gas sensing” LINK

“Tunable diode laser-based two-line thermometry: a noncontact thermometer for active body temperature measurement” LINK




Environment NIR-Spectroscopy Application

“Remote Sensing : Identifying the Spectral Signatures of Invasive and Native Plant Species in Two Protected Areas of Pakistan through Field Spectroscopy” LINK




Agriculture NIR-Spectroscopy Usage

“Prediction of protein and amino acid composition and digestibility in individual feedstuffs and mixed diets for pigs using Near-infrared spectroscopy” LINK

” Genome-Wide Association Studies of Soybean Yield-Related Hyperspectral Reflectance Bands Using Machine Learning-Mediated Data Integration Methods” LINK

“impact of donor nutritional balance on the growth and development of mesenchymal stem cells from caprine umbilical cord Wharton´s jelly” | LINK

“Biosensors : Distinguishing Amyloid -Protein in a Mouse Model of Alzheimers Disease by Label-Free Vibrational Imaging” LINK

“From RGB to NIR: Predicting of Near Infrared Reflectance From Visible Spectrum Aerial Images of Crops” LINK

“Remote Sensing : Ir-UNet: Irregular Segmentation U-Shape Network for Wheat Yellow Rust Detection by UAV Multispectral Imagery” LINK




Forestry and Wood Industry NIR Usage

“Adaptive Bayesian Sum of Trees Model for Covariate Dependent Spectral Analysis. (arXiv:2109.14677v1 [stat.ME])” LINK




Food & Feed Industry NIR Usage

“Study on the aqueous dispersibility of multi-walled carbon nanotubes bearing modified corn starch” | LINK

“Remote Sensing : Incorporating Multi-Scale, Spectrally Detected Nitrogen Concentrations into Assessing Nitrogen Use Efficiency for Winter Wheat Breeding Populations” LINK




Chemical Industry NIR Usage

“Polymers : Partial Polymer Blend for Fused Filament Fabrication with High Thermal Stability” LINK




Petro Industry NIR Usage

“Energy-resolved plasmonic chemistry in individual nanoreactors” | LINK




Medicinal Spectroscopy

“Measurement of Tissue Oximetry in Standing Unsedated and Sedated Horses” LINK




Other

“Structural and chemical modifications of oxides and OH generation by space weathering: Electron microscopic/spectroscopic study of hydrogen-ion-irradiated Al2O3” LINK

“Caractérisation de la composition chimique de l’espèce Aloe macra par spectrométrie proche infrarouge” LINK

“THE IMPACT OF THE ALKYL-AMMONIUM AND-PHOSPHONIUM CATIONS ON THE HYDRATION OF ORGANO-MONTMORILLONITE” LINK

“Optical and structure properties of CH3NH3PbI3 perovskite films doped with Cesium” LINK

“Cultivation and Performance Analysis of Simultaneous Partial Nitrification, ANAMMOX, and Denitratation Granular Sludge” LINK

” 近红外光谱的通用聚苯乙烯牌号在线识别方法” LINK

“Biosensors : An Optical Smartphone-Based Inspection Platform for Identification of Diseased Orchids” LINK



Spectroscopy and Chemometrics/Machine-Learning News Weekly #45, 2021


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Spectroscopy and Chemometrics News Weekly 44, 2021 | NIRS NIR Spectroscopy MachineLearning Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software IoT Sensors QA QC Testing Quality LINK

This week’s NIR news Weekly is sponsored by Your-Company-Name-Here – NIR-spectrometers. Check out their product page … link


Near-Infrared Spectroscopy (NIRS)

“Study on Characteristic Wavelength Extraction Method for Near Infrared Spectroscopy Identification Based on Genetic Algorithm” LINK

“Uji Karakteristik Biochar dengan Pendekatan Near Infrared Spectroscopy (NIRS)” LINK

“Establishment of online quantitative model for moisture content determination of hydroxychloroquine sulfate particles by near infrared spectroscopy” LINK

“Nondestructive detection model of soluble solids content of an apple using visible/near-infrared spectroscopy combined with CARS and MPGA” LINK

“Detecting cadmium contamination in loessal soils using near-infrared spectroscopy in the Xiaoqinling gold area” LINK

“Egg Freshness Evaluation Using Transmission and Reflection of NIR Spectroscopy Coupled Multivariate Analysis” LINK

“Determination of Alcohol Content in Beers of Different Styles Based on Portable Near-Infrared Spectroscopy and Multivariate Calibration” | LINK

“Analysing the Water Spectral Pattern by Near-Infrared Spectroscopy and Chemometrics as a Dynamic Multidimensional Biomarker in Preservation: Rice Germ …” LINK

“Remote Sensing : The Application of NIRS to Determine Animal Physiological Traits for Wildlife Management and Conservation” LINK

“Wavelength selection method for near-infrared spectroscopy based on standard-sample calibration transfer of mango and apple” LINK

“A portable NIR-system for mixture powdery food analysis using deep learning” LINK




Infrared Spectroscopy (IR) and Near-Infrared Spectroscopy (NIR)

“Compositional and sensory quality of beef and its determination by near infrared” LINK

“Butyrylcholinesterase responsive supramolecular prodrug with targeted nearinfrared cellular imaging property” LINK




Raman Spectroscopy

“Quantitative analysis of binary and ternary organo-mineral solid dispersions by Raman spectroscopy for robotic planetary exploration missions on Mars” | OpenAccess LINK




Hyperspectral Imaging (HSI)

“A shallow network for hyperspectral image classification using an autoencoder with convolutional neural network” | LINK

“Hyperspectral camera development on an unmanned aerial vehicle” LINK

“Direct reflectance transformation methodology for drone-based hyperspectral imaging” LINK




Spectral Imaging

“Remote Sensing : Application of Multispectral Camera in Monitoring the Quality Parameters of Fresh Tea Leaves” LINK




Chemometrics and Machine Learning

“Sensors : Adaboost-Based Machine Learning Improved the Modeling Robust and Estimation Accuracy of Pear Leaf Nitrogen Concentration by In-Field VIS-NIR Spectroscopy” LINK

“Discrimination of Manufacturers Origin of Oxytetracycline Using Terahertz Time-Domain Spectroscopy with Chemometric Methods” LINK




Spectroscopy

“Sensors : Non-Invasive Monitoring of Ethanol and Methanol Levels in Grape-Derived Pisco Distillate by Vibrational Spectroscopy” LINK




Equipment for Spectroscopy

“Improving the thermoelectric performances of polymer via synchronously realizing of chemical doping and side-chain cleavage” LINK




Environment NIR-Spectroscopy Application

“Determining physical and mechanical volcanic rock properties via reflectance spectroscopy” LINK

“Unauthorized landfills of solid household and industrial wastes detection in the Arctic and Subarctic territories using remote sensing technologies” LINK

“Evaluating the effects of distinct water saturation states on the light penetration depths of sand-textured soils” LINK




Agriculture NIR-Spectroscopy Usage

“Sorghum Grains Grading for Food, Feed, and Fuel Using NIR Spectroscopy” LINK

“Estimation of leaf area index at the late growth stage of crops using unmanned aerial vehicle hyperspectral images” LINK

“Analysis of Spectral Reflectance Characteristics Using Hyperspectral Sensor at Diverse Phenological Stages of Soybeans” LINK




Horticulture NIR-Spectroscopy Applications

“Data fusion for fruit quality authentication: combining non-destructive sensing techniques to predict quality parameters of citrus cultivars” | LINK




Food & Feed Industry NIR Usage

“Buckwheat Identification by Combined UV-VIS-NIR Spectroscopy and Multivariate Analysis” LINK




Other

“Effect of the annealing temperature on the growth of the silver nanoparticles synthesized by physical route” LINK



Spectroscopy and Chemometrics News Weekly #13, 2021

NIR Calibration-Model Services

NIRS Analytical Laboratory Method Development : Reduce Workload and Response Time | MethodDevelopment modeling LINK

Spectroscopy and Chemometrics News Weekly 12, 2021 | NIRS NIR Spectroscopy MachineLearning Spectrometer Application Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Service Software Sensors QA QC Testing Quality LINK

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Near-Infrared Spectroscopy (NIRS)

“Differentiation between Fresh and Thawed Cephalopods Using NIR Spectroscopy and Multivariate Data Analysis. Foods 2021, 10, 528” LINK

“Ethanol-soluble carbohydrates of cool-season grasses: prediction of concentration by near-infrared reflectance spectroscopy (NIRS) and evaluation of effects of …” LINK

“An Evaluation of Different NIR-Spectral Pre-Treatments to Derive the Soil Parameters C and N of a Humus-Clay-Rich Soil” LINK

“Prediction of Physicochemical Properties in Honeys with Portable Near-Infrared (microNIR) Spectroscopy Combined with Multivariate Data Processing” LINK

“Comparison between single and mixed-species NIRS databases’ accuracy of dairy fiber feed value detection” LINK

“Using autoencoders to compress soil VNIR–SWIR spectra for more robust prediction of soil properties” LINK

“Prediction of some quality properties of rice and its flour by near-infrared spectroscopy (NIRS) analysis.” ricequality Amylose viscosity LINK




Infrared Spectroscopy (IR) and Near-Infrared Spectroscopy (NIR)

“Nitrogen Management Based on Visible/Near Infrared Spectroscopy in Pear Orchards” Remote Sensing LINK

“Applications of near infrared spectroscopy for fish and fish products quality: a review” LINK

“Near Infrared Spectroscopy as a PAT Tool for Monitoring and Control of Protein and Excipient Concentration in Ultrafiltration of Highly Concentrated Antibody Formulations” LINK

“Determination of soluble solid content in market tomatoes using Near-infrared Spectroscopy” LINK

“Discriminating Coalho cheese by origin through near and middle infrared spectroscopy and analytical measures” LINK

“Current and future research directions in computer-aided near-infrared spectroscopy: A perspective” LINK

“Estimation of the Relative Abundance of Quartz to Clay Minerals Using the Visible–Near-Infrared–Shortwave- Infrared Spectral Region” LINK

“Estimating the Lactate Threshold Using Wireless Near-Infrared Spectroscopy and Threshold Detection Analyses” LINK

“Smart SelfAssembly Amphiphilic CyclopeptideDye for NearInfrared WindowII Imaging” LINK

“Application of Long-Wave Near Infrared Hyperspectral Imaging for Determination of Moisture Content of Single Maize Seed” LINK

“Near Infrared Spectroscopy as a PAT Tool for Monitoring and Control of Protein and Excipient Concentration in Ultrafiltration of Highly Concentrated Antibody …” LINK

” Achieving the potential multifunctional near-infrared materials Ca 3 In 2− x Ga x Ge 3 O 12: Cr 3+ using a solid state method” LINK

“ATR-FTIR Microspectroscopy Brings a Novel Insight Into the Study of Cell Wall Chemistry at the Cellular Level” LINK

“Development and performance tests of an on-the-go detector of soil total nitrogen concentration based on near-infrared spectroscopy” LINK

“Mid-Infrared Scattering in -Al2O3 Catalytic Powders” LINK

“Rapid tannin profiling of tree fodders using untargeted mid-infrared spectroscopy and partial least squares regression” LINK

“Intelligent evaluation of taste constituents and polyphenols-to-amino acids ratio in matcha tea powder using near infrared spectroscopy” LINK




Raman Spectroscopy

“In vivo diagnosis of skin cancer with a portable Raman spectroscopic device” LINK




Hyperspectral Imaging (HSI)

” A chemometric view of hyperspectral images” LINK




Chemometrics and Machine Learning

” A synergistic use of chemometrics and deep learning improved the predictive performance of near-infrared spectroscopy models for dry matter prediction in …” LINK

“Soil exchangeable cations estimation using Vis-NIR spectroscopy in different depths: Effects of multiple calibration models and spiking” LINK

“Prediction of Tea Theanine Content using Near-Infrared Spectroscopy and Flower Pollination Algorithm” LINK

“Predicting Oil Content In Ripe Macaw Fruits (Acrocomia Aculeata) From Unripe Ones By Near Infrared Spectroscopy And Pls Regression” LINK

“A Model Based on Clusters of Similar Color and NIR to Estimate Oil Content of Single Olives” LINK

“Quick Determination and Discrimination of Commercial Hand Sanitisers Using Attenuated Total Reflectance-Fourier Transform Infrared Spectroscopy and Chemometrics” LINK

“A synergistic use of chemometrics and deep learning improved the predictive performance of near-infrared spectroscopy models for dry matter prediction in mango fruit” LINK

“Comparative study between Partial Least Squares and Rational function Ridge Regression models for the prediction of moisture content of woodchip samples using a handheld spectrophotometer” LINK

“Classification of Lingwu long jujube internal bruise over time based on visible near-infrared hyperspectral imaging combined with partial least squares-discriminant …” LINK

“Nondestructive qualitative and quantitative analysis of Yaobitong capsule using near-infrared spectroscopy in tandem with chemometrics” LINK

“Near infrared reflectance spectroscopy: classification and rapid prediction of patchouli oil content” LINK

“Chemometric classification of geothermal and non-geothermal ethanol leaf extract of seurapoh (Chromolaena odorata Linn) using infrared spectroscopy” LINK




Process Control and NIR Sensors

“In-Line Technologies for the Analysis of Important Milk Parameters during the Milking Process: A Review” LINK




Environment NIR-Spectroscopy Application

“Remote Sensing, Vol. 13, Pages 1105: Water Conservation Estimation Based on Time Series NDVI in the Yellow River Basin” LINK

“A novel framework to estimate soil mineralogy using soil spectroscopy” LINK




Agriculture NIR-Spectroscopy Usage

“Pentosan polysulfate maculopathy: Prevalence, spectrum of disease, and choroidal imaging analysis based on prospective screening: Pentosan maculopathy: disease spectrum & choroidal analysis” LINK

“An Alternative Approach to Evaluate the Quality of Protein-Based Raw Materials for Dry Pet Food. Animals 2021, 11, 458” LINK

“The use of NIR sensor technology for soil test-based decision making in agriculture” LINK

“Estimation of Starch Hydrolysis in Sweet Potato (Beni haruka) Based on Storage Period Using Nondestructive Near-Infrared Spectrometry. Agriculture 2021, 11, 135” LINK

“Handheld vs. Benchtop NearInfrared Spectrometers – How Do They Compare for Analyzing Forage Nutritive Value?” LINK

“Foods, Vol. 10, Pages 612: Preliminary Insights in Sensory Profile of Sweet Cherries” LINK

“Comparing CalReg performance with other multivariate methods for estimating selected soil properties from Moroccan agricultural regions using NIR spectroscopy” LINK

“Potential of Multivariate Statistical Technique Based on the Effective Spectra Bands to Estimate the Plant Water Content of Wheat Under Different Irrigation Regimes” LINK

“Agriculture, Vol. 11, Pages 239: In-Line Technologies for the Analysis of Important Milk Parameters during the Milking Process: A Review” LINK

“Foods, Vol. 10, Pages 496: Fatty Acid Composition from Olive Oils of Portuguese Centenarian Trees Is Highly Dependent on Olive Cultivar and Crop Year” LINK

“Automated in-field leaf-level hyperspectral imaging of corn plants using a Cartesian robotic platform” LINK

“A novel compact intrinsic safety full range Methane microprobe sensor using “trans-world” processing method based on near- infrared spectroscopy” LINK

“Organic carbon in agricultural and agroforestry soils: Effect of different management practices” LINK

“Machine Learning-Based Approach to Predict Insect-Herbivory-Damage and Insect-Type Attack in Maize Plants Using Hyperspectral Data” LINK

” Spectral reflectance of marine macroplastics in the VNIR and SWIR measured in a controlled environment” LINK




Forestry and Wood Industry NIR Usage

“Chemometric development using portable molecular vibrational spectrometers for rapid evaluation of AVC (Valsa mali Miyabe et Yamada) infection of apple trees” LINK




Food & Feed Industry NIR Usage

“Quantitative Analysis of Colony Number in Mouldy Wheat based on Near Infrared Spectroscopy combined with Colorimetric Sensor” LINK




Pharma Industry NIR Usage

” Integration of transcriptomes analysis with spectral signature of total RNA for generation of affordable remote sensing of Hepatocellular carcinoma in serum …” LINK




Laboratory and NIR-Spectroscopy

” Prediction of meat quality traits in the abattoir using portable near-infrared spectrometers: heritability of predicted traits and genetic correlations with laboratory …” LINK




Other

“Ultrasonic-assisted catalytic transfer hydrogenation for upgrading pyrolysis-oil” LINK

“Quantitation of volatile aldehydes using chemoselective response dyes combined with multivariable data analysis” LINK

“Evaluation and optimization on the reflection and durability of reflective coatings for cool pavement” LINK

“Polyvinyl chloride: chemical modification and investigation of structural and thermal properties” LINK





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Spectroscopy and Chemometrics News Weekly #3, 2021

NIR Calibration-Model Services

Spectroscopy and Chemometrics News Weekly 2, 2021 | NIRS NIR Spectroscopy MachineLearning Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software IoT Sensors QA QC Testing Quality LINK

Spektroskopie und Chemometrie Neuigkeiten Wöchentlich 2, 2021 | NIRS NIR Spektroskopie MachineLearning Spektrometer IoT Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse LINK

Spettroscopia e Chemiometria Weekly News 2, 2021 | NIRS NIR Spettroscopia MachineLearning analisi chimica Spettrale Spettrometro Chem IoT Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem QualityControl LINK




Near-Infrared Spectroscopy (NIRS)

“On the discrimination of soil samplesby derivative diffuse reflectance UV-Vis-NIR spectroscopy and Chemometric methods” LINK

“Quantitative Analysis of Organic Acids in Pomelo Fruit using FT-NIR Spectroscopy Coupled with Network Kernel PLS Regression” LINK

“Determination of foliar nitrogen in oil palm with spectroscopy in the middle infrared (MIR) and near infrared (NIR) by the method of regression of partial least squares of …” LINK

“Low-cost handheld NIR spectroscopy for identification of organic solvents and low-level quantification of water contamination.” LINK

“Prediction of Andrographolide Content in Andrographis paniculata Using NIR Spectroscopy” LINK

“Non-Destructive Prediction of Moisture Content of Philippine Coffea arabica and Coffea liberica Green Beans Using Locally-Developed NIR Spectroscopy Instrument” LINK

“Rapid and nondestructive evaluation of soluble solids content (SSC) and firmness in apple using Vis–NIR spatially resolved spectroscopy” LINK

“Detection of Flavor Adulterated Pu”er Tea by Near-Infrared Spectroscopy” LINK




Infrared Spectroscopy (IR) and Near-Infrared Spectroscopy (NIR)

“Near infrared spectroscopy model for analyzing chemical composition of biomass subjected to Fenton oxidation and hydrothermal treatment” LINK

“Texture evaluation of cooked parboiled rice using nondestructive milled whole grain near infrared spectroscopy” LINK

“Hyperspectral measurement of skin reflectance detects differences in the visible and nearinfrared regions according to race, gender, and body site.” LINK

“Effects of polymer molecular weight on curcumin amorphous solid dispersion; at-line monitoring system based on attenuated total reflectance mid-infrared and near-infrared spectroscopy” LINK

“Near-infrared hyperspectral imaging for monitoring the thickness distribution of thin poly(3,4-ethylenedioxythiophene):poly(styrene sulfonate) (PEDOT:PSS) layers.” LINK

“Improved prediction of potassium and nitrogen in dried bell pepper leaves with visible and near-infrared spectroscopy utilising wavelength selection techniques” LINK

“Identification of Aspergillus species in human blood plasma by infrared spectroscopy and machine learning” LINK

“PLS-DA and Infrared Spectroscopy based rapid and non-destructive discrimination of black ball and gel pen inks for forensic application” forensic LINK

” Analysis of Glycated Hemoglobin by Near-Infrared Spectroscopy” LINK




Hyperspectral Imaging (HSI)

“Spectral feature selection from hyperspectral dataset to identify pistachio leaves infected by Psylla” LINK




Chemometrics and Machine Learning

“Classification of Megathyrsus maximus Accessions Grown in The Colombian Dry Tropical Forest by Nutritional Assessment during contrasting seasons” LINK

“A global calibration model for prediction of intramuscular fat and pH in red meat using hyperspectral imaging” LINK

“Application of near-infrared spectroscopy and chemometrics for the rapid quality assessment of Sargassum fusiforme” LINK

“Comparison of Soil Total Nitrogen Content Prediction Models Based on Vis-NIR Spectroscopy” LINK

“An efficient tea quality classification algorithm based on near infrared spectroscopy and random Forest” LINK

“NIR spectroscopy fruit quality detection algorithm based on the least angle regression model” LINK




Process Control and NIR Sensors

“Free radical detection in water after processing by means of high voltage electrical discharges and high power ultrasound” LINK




Environment NIR-Spectroscopy Application

“Image and Point Data Fusion for Enhanced Discrimination of Ore and Waste in Mining” Minerals LINK




Agriculture NIR-Spectroscopy Usage

“Design of storage time identification system of lettuce based on Adaboost” LINK




Horticulture NIR-Spectroscopy Applications

“Determination of pectin in peach fruit by Fourier transform near infrared spectroscopy.” LINK




Food & Feed Industry NIR Usage

“Lipid and Protein Oxidation Marker Compounds in Horse Meat Determined by MIR Spectroscopy” LINK




Beverage and Drink Industry NIR Usage

“Physical and Chemical Effects of Different Working Gases in Coffee Brewing: A Case Study of Caffè Firenze” LINK

“Simultaneous Determination of Caffeine and Taurine in Energy Drinks by FT-MIR Spectroscopy Coupled with Multivariate Analysis” LINK




Laboratory and NIR-Spectroscopy

“Accurate confidence intervals for inter-laboratory calibration and common mean estimation” LINK




Other

“Alteration in the Amount of Glomalin in Transition from Forest to Field/Meadow” LINK





Digitization in the field of NIR spectroscopy (smart sensors)

Digitalization is advancing, also in NIR spectroscopy, which enables trainable miniature smart sensors e.g. for analyses in the food&feed, chemical and pharmaceutical sectors.

The calibration is the core of a NIR spectroscopy sensor, it enables the numerous applications and should therefore not be the weakest link in the measurement chain.

The development of calibrations that turn NIR spectrometers into smart sensors is done manually by experts (NIR specialist, chemometrician, data scientist) with so-called chemometrics software.

This is very time-consuming (time to market) and the result is person-dependent and thus suboptimal, because each expert has his own preferred way of proceeding. In addition, the calibrations have to be maintained, as new data has been collected in the meantime, which can be used to extend and improve the calibrations.

This is where our automated service comes in, combining the knowledge and good practices of NIR spectroscopy and chemometrics collected in one software and using machine learning to generate optimal calibrations.

Based on this, we have developed a complete technology platform (Time to Market) that covers the entire process from sending NIR + Lab data, to NIR Calibration as a Service, from online purchase of calibrations, to NIR Predictor software that directly evaluates newly measured NIR data locally and generates result reports.

Besides the free desktop version with user interface, the NIR Predictor can also be integrated (OEM). This can be integrated in parallel as a complement to your current Predictor, allowing the user to choose how they want to calibrate. And give them the advantage in NIR feasibility studies and NIR spectrometer evaluations to quickly provide the customer with a solid and accurate calibration that will make their NIR system deliver better results.

Advantages for your NIR users (internal or external)
  • no initial costs (no chemometrics software license required),
  • calculable operating costs (fixed amount instead of time and hourly rate) (calibration development, calibration maintenance)
  • easy to use (no chemometrics and software training),
  • quicker to use (no calibration development work) and
  • better calibrations (precision, accuracy, robustness, …)


Our chargeable service is based on the calibration development and the annual calibration use. Calibration development and calibration use can also be carried out separately (manufacturer / user).

For you as a spectrometer manufacturer, this means that you can deliver your system pre-calibrated for certain applications without incurring software license costs. And without your application specialists having to provide additional calibration services.

The unique advantages of our calibration service together with the free NIR Predictor are:
  • no software license costs (chemometrics software, predictor software, OEM integration)
  • no chemometrics know-how necessary
  • no time needed to develop optimal NIR calibrations.


If interested in using/evaluating the service :

About CalibrationModel.com : Time and knowledge intensive creation and optimization of chemometric evaluation methods for spectrometers as a service to enable more accurate analysis and measurement results.



see also

Paradigm Change in NIR

Five Mistakes to avoid on Digitalization in NIR

NIR – Total cost of ownership (TCO)

OEM / White Label Software

White Paper



NIR-Spectroscopy and Chemometrics News Weekly #43, 2020

NIR Calibration-Model Services

The free NIR-Predictor is an easy to use software for all NIR devices to produce quantitative results out of spectral data. Supports GRAMS .SPC, CSV, JCAMP and multiple native file formats of mobile and desktop spectrometers. VisNIR NIRS labequipment LINK

Do you use a near-infrared spectrometer with chemometric Methods? This will save you time | NIR NIRS VisNIR spectroscopy foodanalysis LINK

Spectroscopy and Chemometrics News Weekly 42, 2020 | NIRS NIR Spectroscopy MachineLearning Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software IoT Sensors QA QC Testing Quality LINK




Near-Infrared Spectroscopy (NIRS)

“Meat freshness revealed by visible to near-infrared spectroscopy and principal component analysis” LINK

“Fish Freshness Assessment using NIR spectroscopy” LINK

“Discrimination of Various Clones of Black Tea Using NIR Spectroscopy” LINK

“Latest work using handheld and benchtop NIRS devices to predict forage nutritive value” LINK

“Combining multivariate method and spectral variable selection for soil total nitrogen estimation by VisNIR spectroscopy” LINK

“Combination of NIR spectroscopy and machine learning for monitoring chili sauce adulterated with ripened papaya” LINK

“USING SPECTROSCOPY AND SUPPORT VECTOR REGRESSION TO PREDICT GASOLINE CHARACTERISTICS: A COMPARISON OF 1H NMR AND NIR” LINK

“Determination of metmyoglobin in cooked tan mutton using Vis/NIR hyperspectral imaging system.” | LINK

“Towards Fruit Maturity Estimation Using NIR Spectroscopy” LINK

“Remote and Vis-NIR spectra sensing potential for soil salinization estimation in the eastern coast of Urmia hyper saline lake, Iran” LINK




Infrared Spectroscopy (IR) and Near-Infrared Spectroscopy (NIR)

“Control of the extractable content of bioactive compounds in coffee beans by near infrared hyperspectral imaging” LINK

“Detection of Adulteration of Tapioca Starch with Dolomite by near Infrared Hyperspectral Imaging” LINK

“Near infrared absorption spectroscopy for the quantification of unsulfated alcohol in sodium lauryl ether sulfate” LINK

“A Residual Neural Network based Method for The Classification of Tobacco Cultivation Regions Using Near-infrared Spectroscopy Sensors” LINK

“Identification of ginseng according to geographical origin by near-infrared spectroscopy and pattern recognition” LINK

“Application of Near-Infrared Spectroscopy for Rice Characterization Using Machine Learning” LINK




Hyperspectral Imaging (HSI)

“Heavy metal Hg stress detection in tobacco plant using hyperspectral sensing and data-driven machine learning methods” LINK




Chemometrics and Machine Learning

“Assessment of total antioxidant capacity of altiplano colored quinoa (Chenopodium quinoa Willd) by visible and near-infrared diffuse reflectance spectroscopy and chemometrics” LINK

“Non-destructive discrimination of Illicium verum from poisonous adulterant using Vis/NIR hyperspectral imaging combined with chemometrics” LINK

“Classification of Smoke Contaminated Cabernet Sauvignon Berries and Leaves Based on Chemical Fingerprinting and Machine Learning Algorithms.” LINK

“Evaluation of temperature compensation methods for a nearinfrared calibration to predict the viscosity of micellar liquids” LINK

“FTIR spectroscopy with chemometrics for determination of Tylosin residues in milk” LINK




Optics for Spectroscopy

“Synthesis, growth, optical and third-order nonlinear optical properties of glycine sodium nitrate single crystal for photonic device applications” LINK




Research on Spectroscopy

“Low-cost analytic method for the identification of Cinnamon adulteration” LINK




Equipment for Spectroscopy

“Comparative analysis of rapid quality evaluation of Salvia miltiorrhiza (Danshen) with Fourier transform near-infrared spectrometer and portable near-infrared …” LINK




Process Control and NIR Sensors

“Experimental investigations on DC magnetron sputtering process parameters with optimization of Al thin film properties deposited on glass substrate” LINK




Agriculture NIR-Spectroscopy Usage

“Foods, Vol. 9, Pages 1273: Changes in Physical and Chemical Properties of Thermally and Oxidatively Degraded Sunflower Oil and Palm Fat” LINK

“Map-based site-specific seeding of consumption potato production using high-resolution soil and crop data fusion” LINK

“Short-term tundra plant-community nutrient responses to herbivory and warming: New insights from Near infrared-reflectance spectroscopy methodology” LINK

“Evaluation of soybean condition under various fertilizer application by the relationship of the red and near-infrared bands reflectance in scatter plot” LINK

“Prediction Accuracy Improvement of Indonesian Dairy Cattle Fiber Feed Compositions Using Near-Infrared Reflectance Spectroscopy Local Database” LINK




Horticulture NIR-Spectroscopy Applications

“Overall precision test of near infrared spectroscopy on mango fruits (Mangifera indica CV.’Nam Dok Mai Si Thong’) by on-line and off-line systems” LINK

“The overall precision test for near infrared scanning and reference method for the determination of soluble solids content and pH of mango for processing factory” LINK

“Non-destructive visible and short-wave near-infrared spectroscopic data estimation of various physicochemical properties of Fuji apple (Malus pumila) fruits at different maturation stages” LINK




Laboratory and NIR-Spectroscopy

“Pasture Quality Analysis–Comparison of pasture analysis techniques and results” LINK




Other

“Chemodiversity and antibacterial activity of the essential oil of leaves of Croton argyrophyllus Kunth” LINK





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