Spectroscopy and Chemometrics/Machine-Learning News Weekly #20, 2022

NIR Calibration-Model Services

NIR User? Get better results faster | Food Science QC Lab Laboratory Manager chemist LabWork Chemie analytik LINK

Spectroscopy and Chemometrics News Weekly 19, 2022 | 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 19, 2022 | NIRS NIR Spektroskopie MachineLearning Spektrometer IoT Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse LINK

Spettroscopia e Chemiometria Weekly News 19, 2022 | NIRS NIR Spettroscopia MachineLearning analisi chimica Spettrale Spettrometro Chem IoT Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem QualityControl LINK

Near-Infrared Spectroscopy (NIRS)

“Why People and AI Make Good Business Partners” | human AI relationships AI as a Service ( AIaaS ) LabManager NIRS MachineLearning LINK

“A novel aquaphotomics based approach for understanding salvianolic acid A conversion reaction with near infrared spectroscopy” LINK

“ex type determination in papaya seeds and leaves using near infrared spectroscopy combined with multivariate techniques and machine learnin” LINK


“Rapid authentication and composition determination of cellulose films by UV-VIS-NIR spectroscopy” LINK

“Interoceptive Attentiveness Induces Significantly More PFC Activation during a Synchronized Linguistic Task Compared to a Motor Task as Revealed by Functional Near-Infrared Spectroscopy” | LINK

“Near-infrared spectroscopy and machine learning-based technique to predict quality-related parameters in instant tea” | LINK

“Sensors : LASSO Homotopy-Based Sparse Representation Classification for fNIRS-BCI” LINK

“Using metaheuristic algorithms to improve the estimation of acidity in Fuji apples using NIR spectroscopy” LINK

“Analyzing Classification Performance of fNIRS-BCI for Gait Rehabilitation Using Deep Neural Networks” LINK

“Multimodal diffuse optical system integrating DSCA-NIRS and cSFDI for measuring tissue metabolism” LINK

extruded granules extruder NIR AEE audible acoustic emission granule drying process PAT LINK

“Fast Noniterative Data Analysis Method for Frequency-Domain Near-Infrared Spectroscopy with the Microscopic Beer-Lambert Law” LINK

“Vis-NIR Hyperspectral Dimensionality Reduction for Nondestructive Identification of China Northeast Rice” | LINK

“FT-NIR Spectroscopy for the Non-Invasive Study of Binders and Multi-Layered Structures in Ancient Paintings: Artworks of the Lombard Renaissance as Case Studies” LINK

“In Vivo Measurement Strategy for Near-Infrared Noninvasive Glucose Detection and Human Body Verification” LINK

“A Standard-Free Calibration Transfer Strategy for a Discrimination Model of Apple Origins Based on Near-Infrared Spectroscopy” LINK

“Comparative study on the real-time monitoring of a fluid bed drying process of extruded granules using near-infrared spectroscopy and audible acoustic emission” LINK

“Fast detection of cotton content in silk/cotton textiles by handheld near-infrared spectroscopy: a performance comparison of four different instruments” LINK

“Evaluation of optical properties of tofu samples produced with different coagulation temperatures and times using near-infrared transmission spectroscopy” LINK

“Near-Infrared Spectroscopy and Mode Cloning (NIR-MC) for In-Situ Analysis of Crude Protein in Bamboo” LINK

“Near-infrared spectroscopy to estimate the chemical element concentration in soils and sediments in a rural catchment” LINK

“Ensemble classification and regression techniques combined with portable near infrared spectroscopy for facile and rapid detection of water adulteration in bovine …” LINK

“Characterization of crude oils with a portable NIR spectrometer” CrudeOil NIRspectrometer LINK

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

“A Device for Measuring Apple Sweetness Using Near Infrared Spectroscopy” LINK

“Nearinfrared fluorophores based on heptamethine cyanine dyes: from their synthesis and photophysical properties to recent optical sensing and bioimaging applications” LINK

“Use of Attenuated Total Reflection Fourier Transform Infrared Spectroscopy and Principal Component Analysis for the Assessment of Engine Oils” | LINK

“Near-Infrared Hyperspectral Imaging Pipelines for Pasture Seed Quality Evaluation: An Overview” LINK

“Analyzing the Water Confined in Hydrogel Using Near-Infrared Spectroscopy” LINK

“Near-infrared spectra of aqueous glucose solutions” LINK

“Determination of storage period of harvested plums by nearinfrared spectroscopy and quality attributes” LINK

Hyperspectral Imaging (HSI)

“Rapid Detection of Different Types of Soil Nitrogen Using Near-Infrared Hyperspectral Imaging” LINK

“Near-Infrared Hyperspectral Imaging Pipelines for Pasture Seed Quality Evaluation: An Overview” LINK

“Estimating soil moisture content under grassland with hyperspectral data using radiative transfer modelling and machine learning” LINK

“Improving rice nitrogen stress diagnosis by denoising strips in hyperspectral images via deep learning” LINK

“Identification of Soil Arsenic Contamination in Rice Paddy Field Based on Hyperspectral Reflectance Approach” LINK

Chemometrics and Machine Learning

“Remote Sensing : Early Detection of Dendroctonus valens Infestation with Machine Learning Algorithms Based on Hyperspectral Reflectance” LINK

“Applied microwave power estimation of black carrot powders using spectroscopy combined with chemometrics” LINK

DataScientist Job: Expectation vs. Reality [infographic] BigData DataScience Analytics AI MachineLearning ArtificialIntelligence Data DataAnalytics Python SQL Statistics DataViz Careers Jobs FeatureEngineering DataPrep DataCleaning LINK

“Agronomy : Detection of Adulterations in Fruit Juices Using Machine Learning Methods over FT-IR Spectroscopic Data” LINK

“Reflectance Based Models for Non-Destructive Prediction of Lycopene Content in Tomato Fruits” | LINK

“The evolution of chemometrics coupled with near infrared spectroscopy for fruit quality evaluation” LINK

“Machine Learning Strategies for the Retrieval of Leaf-Chlorophyll Dynamics: Model Choice, Sequential Versus Retraining Learning, and Hyperspectral Predictors” | LINK

“In-line near-infrared analysis of milk coupled with machine learning methods for the daily prediction of blood metabolic profile in dairy cattle” LINK

“Near-infrared spectroscopy with chemometrics for identification and quantification of adulteration in high-quality stingless bee honey” LINK

“Rapid identification and quantification of intramuscular fat adulteration in lamb meat with VIS-NIR spectroscopy and chemometrics methods” LINK

Optics for Spectroscopy

“Spectrum Reconstruction with Filter-Free Photodetectors Based on Graded-Band-Gap Perovskite Quantum Dot Heterojunctions” LINK


“Sensors : Dietary Patterns Associated with Diabetes in an Older Population from Southern Italy Using an Unsupervised Learning Approach” | LINK

Research on Spectroscopy

“A Study of C= O… HO and OH… OH (Dimer, Trimer, and Oligomer) Hydrogen Bonding in a Poly (4-vinylphenol) 30%/Poly (methyl methacrylate) 70% Blend and its …” LINK

“Deeper insights into the photoluminescence properties and (photo) chemical reactivity of cadmium red (CdS1− xSex) paints in renowned twentieth century …” | LINK

Equipment for Spectroscopy

“Green Textile Materials for Surface Enhanced Raman Spectroscopy Identification of Pesticides Using a Raman Handheld Spectrometer for In-Field Detection” LINK

“Characterization of Crude Oils with a Portable Nir Spectrometer” LINK

“Discrimination of the Red Jujube Varieties Using a Portable NIR Spectrometer and Fuzzy Improved Linear Discriminant Analysis” LINK

“Rapid authentication of the geographical origin of milk using portable near‐infrared spectrometer and fuzzy uncorrelated discriminant transformation” LINK

Environment NIR-Spectroscopy Application

“Remote Sensing : Estimating Forest Soil Properties for Humus Assessment—Is Vis-NIR the Way to Go?” LINK

“Sensors : Evaluation of Two Portable Hyperspectral-Sensor-Based Instruments to Predict Key Soil Properties in Canadian Soils” LINK

“Evaluation of Vis-Nir Pretreatments Combined with Pls Regression for Estimation SOC, Cec and Clay in Silty Soils from Eastern Croatia” LINK

“Comparing Two Different Development Methods of External Parameter Orthogonalization for Estimating Organic Carbon from Field-Moist Intact Soils by Reflectance …” LINK

Agriculture NIR-Spectroscopy Usage

“Site-specific seeding for maize production using management zone maps delineated with multi-sensors data fusion scheme” LINK

“Rapid Identification of Soybean Varieties by Terahertz Frequency-Domain Spectroscopy and Grey Wolf Optimizer-Support Vector Machine” | LINK

“A LUCASbased midinfrared soil spectral library: Its usefulness for soil survey and precision agriculture” LINK

“Identification of Microplastics in Biosolids Using Ftir and Vis-Nir Spectroscopy Enhanced by Chemometric Methods” LINK

“Agriculture : Feature Wavelength Selection Based on the Combination of Image and Spectrum for Aflatoxin B1 Concentration Classification in Single Maize Kernels” LINK

Food & Feed Industry NIR Usage

“Agronomy : Analysis of Physico-Chemical and Organoleptic Fruit Parameters Relevant for Tomato Quality” LINK

Chemical Industry NIR Usage

“Polymers : Microscopic and Structural Studies of an Antimicrobial Polymer Film Modified with a Natural Filler Based on Triterpenoids” LINK

Laboratory and NIR-Spectroscopy

“Laboratory Hyperspectral Image Acquisition System Setup and Validation” LINK


“A sensor combination based automatic sorting system for waste washing machine parts” LINK


Spectroscopy and Chemometrics/Machine-Learning News Weekly #14, 2022

NIR Calibration-Model Services

Spectroscopy and Chemometrics News Weekly 13, 2022 | 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 13, 2022 | NIRS NIR Spektroskopie MachineLearning Spektrometer IoT Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse LINK

Spettroscopia e Chemiometria Weekly News 13, 2022 | NIRS NIR Spettroscopia MachineLearning analisi chimica Spettrale Spettrometro Chem IoT Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem QualityControl LINK

Near-Infrared Spectroscopy (NIRS)

“NIR Spectroscopy and Aquaphotomics Approach to Identify Soil Characteristics as a Function of the Sampling Depth” LINK

“Improving the multi-class classification of Alzheimer’s disease with machine learning-based techniques: An EEG-fNIRS hybridization study” LINK

“A novel methodology for determining effectiveness of preprocessing methods in reducing undesired spectral variability in near infrared spectra” LINK


“Near infrared‐based process analytical technology module for estimating gelatinization optimal point” LINK

“Near Infrared Technology in Agricultural Sustainability: Rapid Prediction of Nitrogen Content from Organic Fertilizer” LINK

“Gasoline octane number prediction from near-infrared spectroscopy with an ANN-based model” LINK

“Rapid On-site Identification of Geographical Origin and Storage Age of Tangerine Peel by Near-infrared Spectroscopy” LINK

“Empirical mode decomposition of near-infrared spectroscopy signals for predicting oil content in palm fruits” LINK

“Miniaturization in NIR Spectroscopy Reshapes Chemical Analysis” LINK

“Unscrambling spectral interference and matrix effects in Vitis vinifera Vis-NIR spectroscopy: Towards analytical grade ‘in vivo’sugars and acids quantification” LINK

“Research Progress of Bionic Materials Simulating Vegetation Visible-Near Infrared Reflectance Spectra” LINK

“Latent Variable Machine Learning Methods Applied for NIR Quantitative Analysis of Coffee” LINK

“Identification of informative spectral ranges for predicting major chemical constituents in corn using NIR spectroscopy” LINK

“Vis-NIR Spectroscopy and Machine Learning Methods for the Discrimination of Transgenic Brassica napus L. and Their Hybrids with B. juncea” LINK

“Applied Sciences : Hidden Information in Uniform Design for Visual and Near-Infrared Spectrum and for Inkjet Printing of Clothing on Canvas to Enhance Urban Security” LINK

“LIONirs: flexible Matlab toolbox for fNIRS data analysis” LINK

Raman Spectroscopy

“Raman Spectroscopic Detection and Quantification of Macro- and Microhematuria in Human Urine” LINK

Hyperspectral Imaging (HSI)

“Prediction of total carotenoids, color and moisture content of carrot slices during hot air drying using noninvasive hyperspectral imaging technique” LINK

“Growth simulation of Pseudomonas fluorescens in pork using hyperspectral imaging” LINK

“Estimation of Leaf Water Content of Different Leaves from Different Species Using Hyperspectral Reflectance Data” LINK

Chemometrics and Machine Learning

“Automation : Predictive Performance of Mobile Vis-NIR Spectroscopy for Mapping Key Fertility Attributes in Tropical Soils through Local Models Using PLS and ANN” LINK

“Prediction of South American Leaf Blight and Disease-Induced Photosynthetic Changes in Rubber Tree, Using Machine Learning Techniques on Leaf Hyperspectral …” LINK

“Proximal spectroscopy sensing for sugarcane quality prediction and spatial variability mapping” LINK

“Variable Selection Based on Gray Wolf Optimization Algorithm for the Prediction of Saponin Contents in Xuesaitong Dropping Pills Using NIR Spectroscopy” | LINK

“Prediction of soil organic matter content based on characteristic band selection method” LINK

“Sensors : Algorithm of Stability-Analysis-Based Feature Selection for NIR Calibration Transfer” LINK

“Modelling soil water retention and water‐holding capacity with visible-near infrared spectra and machine learning” LINK

“Machine learning for atherosclerotic tissue component classification in combined near-infrared spectroscopy intravascular ultrasound imaging: Validation against …” LINK

“Modelling soil water retention and waterholding capacity with visiblenear infrared spectra and machine learning” LINK

“Cancers : Novel Non-Invasive Quantification and Imaging of Eumelanin and DHICA Subunit in Skin Lesions by Raman Spectroscopy and MCR Algorithm: Improving Dysplastic Nevi Diagnosis” LINK


“Evaluation of portable vibrational spectroscopy for identifying plasticizers in dairy tubing” LINK

Optics for Spectroscopy

“Chemosensors : Carbocyanine-Based Fluorescent and Colorimetric Sensor Array for the Discrimination of Medicinal Compounds” LINK

“Platinum(II)Acetylide Conjugated Polymer Containing AzaBODIPY Moieties for Panchromatic Photodetectors” LINK

Equipment for Spectroscopy

“Polymers : Role of Macrodiols in the Synthesis and Thermo-Mechanical Behavior of Anti-Tack Water Borne Polyurethane Dispersions” LINK

Process Control and NIR Sensors

“A Perfect Pair: Stabilized Black Phosphorous Nanosheets Engineering with Antimicrobial Peptides for Robust Multidrug Resistant Bacteria Eradication” LINK

Environment NIR-Spectroscopy Application

“Long-Term Liming Reduces the Emission and Temperature Sensitivity of N2o Via Altering Denitrification Functional Gene Ratio in Acidic Soil” LINK

“Environmental metabolomics approaches to identify and enhance secondary compounds in medicinal plants for bio-based plant protection” LINK

“Soil moisture determines nitrous oxide emission and uptake” LINK

“Remote Sensing : Evaluating the Capability of Satellite Hyperspectral Imager, the ZY1-02D, for Topsoil Nitrogen Content Estimation and Mapping of Farmlands in Black Soil Area, China” LINK

“Remote Sensing : Extending the GOSAILT Model to Simulate Sparse Woodland Bi-Directional Reflectance with Soil Reflectance Anisotropy Consideration” LINK

Agriculture NIR-Spectroscopy Usage

“Evaluation of Near-Infrared Reflectance and Transflectance Sensing System for Predicting Manure Nutrients” LINK

“Ecoenzymatic stoichiometry reflects the regulation of microbial carbon and nitrogen limitation on soil nitrogen cycling potential in arid agriculture ecosystems” | LINK

“Remote Sensing : Phenotypic Traits Estimation and Preliminary Yield Assessment in Different Phenophases of Wheat Breeding Experiment Based on UAV Multispectral Images” LINK

“Agronomy : Evaluation of Methods for Measuring Fusarium-Damaged Kernels Wheat” LINK

“Agriculture : Non-Destructive Detection of pH Value of Kiwifruit Based on Hyperspectral Fluorescence Imaging Technology” LINK

“Agronomy : Optical Spectrometry to Determine Nutrient Concentrations and other Physicochemical Parameters in Liquid Organic Manures: A Review” LINK

“Agriculture : The Effect of Tytanit on Fibre Fraction Content in Medicago x varia T. Martyn and Trifolium pratense L. Cell Walls” LINK

Horticulture NIR-Spectroscopy Applications

“Redefining the impact of preharvest factors on peach fruit quality development and metabolism: A review” LINK

“Accurate nondestructive prediction of soluble solids content in citrus by nearinfrared diffuse reflectance spectroscopy with characteristic variable selection” LINK

Forestry and Wood Industry NIR Usage

“Spectrometric Prediction of Nitrogen Content in Different Tissues of Slash Pine Trees” LINK

Food & Feed Industry NIR Usage

“Effects of Irrigation Strategy and Plastic Film Mulching on Soil N 2 O Emissions and Fruit Yields of Greenhouse Tomato” LINK

“Mini shortwave Spectroscopic Techniques and Multivariate Statistical Analysis as a Tool for Testing intact Cocoa beans at farmgate for Quality Control in Ghana” LINK

“Foods : Gluten Conformation at Different Temperatures and Additive Treatments” LINK

Pharma Industry NIR Usage

“Revealing the Effect of Heat Treatment on the Spectral Pattern of Unifloral Honeys Using Aquaphotomics” LINK

“Biomedicines : Pathophysiological Response to SARS-CoV-2 Infection Detected by Infrared Spectroscopy Enables Rapid and Robust Saliva Screening for COVID-19” LINK


“Unraveling the potential of phenomic selection within and among diverse breeding material of maize (Zea mays L.)” LINK

“Applied Sciences : Impact of Pheidole fallax (Hymenoptera: Formicidae) as an Ecosystem Engineer in Rehabilitated Coal Mine Areas” LINK

“The Spectral Mixture Residual: A Source of LowVariance Information to Enhance the Explainability and Accuracy of Surface Biology and Geology Retrievals” LINK

“Glycosylated MoS2 Sheets for Capturing and Deactivating E. coli Bacteria: Combined Effects of Multivalent Binding and Sheet Size” LINK