Spectroscopy and Chemometrics/Machine-Learning News Weekly #28, 2022

NIR Calibration-Model Services

Portable Near-Infrared Spectroscopy LINK

Efficient development of new quantitative prediction equations for multivariate data like NIR spectra | spectral LINK

Spectroscopy and Chemometrics News Weekly 27, 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 27, 2022 | NIRS NIR Spektroskopie MachineLearning Spektrometer IoT Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse LINK

Spettroscopia e Chemiometria Weekly News 27, 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)

” NNB Monitoring and prediction of sensory shelf-life in strawberry with ultraviolet-visible-near-infrared (UV-VIS-NIR) spectroscopy” LINK

“Near Infrared Spectrograph (NIRSpec)” NASAWebb LINK

“Agronomic characterization of anaerobic digestates with near-infrared spectroscopy” LINK

“Near InfraredTriggered Theranostic Nanoplatform with Controlled Release of HSP90 Inhibitor for Synergistic Mild Photothermal and Enhanced Nanocatalytic Therapy with Hypoxia Relief” LINK

“Research on Online Rapid Sorting Method of Waste Textiles Based on Near-Infrared Spectroscopy and Generative Adversity Network” | LINK

“Agriculture : A First Attempt to Combine NIRS and Plenoptic Cameras for the Assessment of Grasslands Functional Diversity and Species Composition” LINK

“Foods : Classification of Tea Quality Levels Using Near-Infrared Spectroscopy Based on CLPSO-SVM” LINK

“Near-infrared spectroscopy combined with pattern recognition algorithms to quickly classify raisins” | LINK

“Assessment by Multi‐Distance Hyperspectral NIRS of Changes in the Oxidation State of Cytochrome C Oxidase (oxCCO) to Carotid Artery Compressions” LINK

“Imaging near-infrared luminescent nanoformulations to guide drug delivery and photoinduced therapy” LINK

“Positive Association between NIRS‐derived measures of Microvascular Reactivity and Mitochondrial Capacity in the Quadriceps and Hamstrings” LINK

“Is intraoperative near infrared spectroscopy a reliable monitoring method in preventing neurocognitive dysfunction in cardiac surgery?” LINK

“Fusion models for detection of soluble solids content in mandarin by Vis/NIR transmission spectroscopy combined external factors” LINK

“Enhanced near-infrared reflectance and functional characteristics of nano metal oxide embedded alkyd coatings” LINK

“Webb spectrum showcases galaxy’s composition” NIRSpec NearInfrared Spectrograph chemical composition Webbtelescope WebbSpaceTelescope webbfirstimages LINK

“Field-scale spatial correlation between soil and Vis-NIR spectra in the Cerrado biome of Central Brazil” LINK

“Metaheuristic algorithms in visible and near infrared spectra to detect excess nitrogen content in tomato plants” LINK

“Aquaphotomics for monitoring of groundwater using short-wavelength near-infrared spectroscopy” LINK

“Classifying waste wood from Amazonian species by near-infrared spectroscopy (NIRS) to improve charcoal production” LINK

“Rapid Determination of Urea Formaldehyde Resin Content in Wood Fiber Mat Using Near-infrared Spectroscopy” LINK

“… on early identification of freshness decay of fresh‐cut kiwifruit during cold chain storage by Fourier transform‐near infrared spectroscopy combined with chemometrics” LINK

“NIR spectroscopy for rapid measurement of moisture and cannabinoid contents of industrial hemp (Cannabis sativa)” LINK

“A feasibility study on nondestructive classification of frozen Atlantic salmon (Salmo salar) fillets based on temperature history at the logistics using NIR spectroscopy” LINK

“A review on hybrid strategy-based wavelength selection methods in analysis of near-infrared spectral data” LINK

“Deep Learning-Based Multilevel Classification of Alzheimer’s Disease Using Non-invasive Functional Near-Infrared Spectroscopy” LINK

“Non-Invasive Detection of Anti-Inflammatory Bioactivity and Key Chemical Indicators of the Commercial Lanqin Oral Solution by Near Infrared Spectroscopy” | LINK




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

” The Importance of Wavelength Selection in On-Scene Identification of Drugs of Abuse with Portable Near-Infrared Spectroscopy” LINK

“Tunable Infrared Sensing Properties of MXenes Enabled by Intercalants” LINK

“Longwave Infrared Hyperspectral Emissivity Retrieval with Robustness to Spectral Uncertainty” LINK

“Rapid identification of the geographic origin of Taiping Houkui green tea using nearinfrared spectroscopy combined with a variable selection method” LINK




Raman Spectroscopy

“Highly Scalable, Wearable Surface-Enhanced Raman Spectroscopy” LINK




Hyperspectral Imaging (HSI)

“A New Method for Calculating Water Quality Parameters by Integrating Space-Ground Hyperspectral Data and Spectral-In situ Assay Data” LINK

“Research on hyperspectral band selection method for visual interpretation” LINK

“Classification of chemical species for nuclear reactor inspections using SWIR hyperspectral imaging” LINK




Chemometrics and Machine Learning

“Experimentation on Spectra Data Regression Using Dense Multilayer Neural Networks with Common Pre-processing” | LINK

“Top-down sensory prediction in the infant brain at 6 months is correlated with language development at 12 and 18 months” LINK

“Aerobic Fitness as a Predictor of Conduit, Resistance and, Microvascular Arterial Function” LINK

“In silico NIR spectroscopy-a review. Molecular fingerprint, interpretation of calibration models, understanding of matrix effects and instrumental difference” LINK

“Linear Calibration Methods” | LINK

“Performance evaluation of variable selection methods coupled with partial least squares regression to determine the target component in solid samples” LINK

“Multivariate methods with feature wavebands selection and stratified calibration for soil organic carbon content prediction by VIS‐NIR Spectroscopy” LINK




Optics for Spectroscopy

“Fibers : The Mechanical Response of Epoxy-Sisal Composites Considering Fiber Anisotropy: A Computational and Experimental Study” LINK




Facts

“Precision Farming Using Image Processing and Machine Learning” LINK

“Do Racial Differences Exist in Mechanoreflex Sensitivity in Young Healthy Males?” LINK


Research on Spectroscopy

illicitdrug analysis cocaine MDMA Ketamine methamphetamine amphetamine GHB LINK

“Coatings : Stability of Polyethylene Glycol-Coated Copper Nanoparticles and Their Optical Properties” LINK

“Selection of the Effective Characteristic Spectra Based on the Chemical Structure and Its Application in Rapid Analysis of Ethanol Content in Gasoline” LINK

“Evaluation of Blend Uniformity and Terminal Point during Continuous Mixing in Water for Modified Double-Base Propellant Components Using a Near-Infrared Method” LINK




Equipment for Spectroscopy

“A feasibility study on the use of a pocket-sized NIR spectrometer and multivariate algorithm to distinguish expired drugs from unexpired ones” LINK




Environment NIR-Spectroscopy Application

“Can in situ spectral measurements under disturbance-reduced environmental conditions help improve soil organic carbon estimation?” LINK




Agriculture NIR-Spectroscopy Usage

“Remote Sensing : Cropping Patterns of Annual Crops: A Remote Sensing Review” LINK

“Analysis of Protein Denaturation, and Chemical Visualization, of Frozen Grass Carp Surimi Containing Soluble Soybean Polysaccharides” LINK

“Can soil spectroscopy contribute to soil organic carbon monitoring on agricultural soils?” LINK




Horticulture NIR-Spectroscopy Applications

“Spectrum classification of citrus tissues infected by fungi and multispectral image identification of early rotten oranges” LINK




Forestry and Wood Industry NIR Usage

“Collecting Wood Core Samples from Macassar Ebony (Diospyros celebica Bakh.) for Multi-Purpose Analysis using Pickering Punch” LINK




Food & Feed Industry NIR Usage

“Fluoride effect indicators in Phaseolus vulgaris seeds and seedlings” | LINK

“Applications of the Remote Sensing Technology to Detect and Monitor the Rust Disease in the Wheat-a Literature Review” LINK

“Applied Sciences : Meat 4.0: Principles and Applications of Industry 4.0 Technologies in the Meat Industry” LINK




Laboratory and NIR-Spectroscopy

“Optical properties of ‘Gala'(Malus pumila) apple pulp and their relationship with internal quality” LINK




Other

“Photochromism of Coordination Compounds” LINK

“Structural and Optical Characterization of Mechanochemically Synthesized CuSbS2 Compounds” LINK

“การ ตรวจ สอบ โรค แอ น แทรก โน ส ใน มะม่วง พันธุ์ น้ำดอกไม้ สี ทอง ด้วย เนีย ร์ อินฟราเรด สเปก โทร ส โก ปี” LINK

“Growth and characterization of nonlinear optical crystal glycine sodium nitrate and its biological activity” | LINK





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Spectroscopy and Chemometrics Machine-Learning News Weekly #18, 2022

NIR Calibration-Model Services

Do you use Molecular Spectroscopy with Multivariate Regression Models? That will save you development time LINK

Spectroscopy and Chemometrics News Weekly 17, 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 17, 2022 | NIRS NIR Spektroskopie MachineLearning Spektrometer IoT Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse LINK

Spettroscopia e Chemiometria Weekly News 17, 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)

“Towards a NIR Spectroscopy ensemble learning technique competing with the standard ASTM-CFR: An optimal boosting and bagging extreme learning machine …” LINK

“Near-infrared spectroscopy and HPLC combined with chemometrics for comprehensive evaluation of six organic acids in Ginkgo biloba leaf extract” | LINK

“Application of near infrared spectroscopy and real time release testing combined with statistical process control charts for on-line quality control of industrial …” LINK

“Agronomy : Quality Assessment of Red Wine Grapes through NIR Spectroscopy” LINK

“An authenticity method for determining hybrid rice varieties using fusion of LIBS and NIRS” LINK

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

“Quantitative Analysis of Agricultural Compost Indicator Factors Based on Different Nir Feature Variable Selection Methods” LINK

“Near-infrared spectroscopy for the inline classification and characterization of fruit juices for a product-customized flash pasteurization” LINK

“Foods : Determination of Cultivation Regions and Quality Parameters of Poria cocos by Near-Infrared Spectroscopy and Chemometrics” LINK

“Prediction of formaldehyde and residual methanol concentration in formalin using near infrared spectroscopy” LINK

“Feasibility of Near-Infrared Spectroscopy for Rapid Detection of Available Nitrogen in Vermiculite Substrates in Desert Facility Agriculture” LINK

“Near-infrared spectroscopy and HPLC combined with chemometrics for comprehensive evaluation of six organic acids in Ginkgo biloba leaf extract” LINK

“A Review of Visible and Near-Infrared (Vis-NIR) Spectroscopy Application in Plant Stress Detection” LINK

“Plants : Comparative Determination of Phenolic Compounds in Arabidopsis thaliana Leaf Powder under Distinct Stress Conditions Using Fourier-Transform Infrared (FT-IR) and Near-Infrared (FT-NIR) Spectroscopy” LINK

“A feasibility study on improving the non-invasive detection accuracy of bottled Shuanghuanglian oral liquid using near infrared spectroscopy” LINK

“Application of portable visible and near-infrared spectroscopy for rapid detection of cooking loss rate in pork: Comparing spectra from frozen and thawed pork” LINK

“Development of a calibration model for near infrared spectroscopy using a convolutional neural network” LINK

“Feasibility of near infrared spectroscopy to classify lamb hamburgers according to the presence and percentage of cherry as a natural ingredient” LINK

“Gaming behavior and brain activation using functional near-infrared spectroscopy, Iowa gambling task, and machine learning techniques” | LINK

“A non-motorized spectro-goniometric system to measure the bi-directional reflectance spectra of particulate surfaces in the visible and near-infrared” LINK

“Sand fractions micromorphometry detected by VisNIRMIR and its impact on water retention” LINK

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




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

“Infrared Organic Photodetectors Employing Ultralow Bandgap Polymer and Non-Fullerene Acceptors for Biometric Monitoring” | LINK

“Infrared Organic Photodetectors Employing Ultralow Bandgap Polymer and NonFullerene Acceptors for Biometric Monitoring” LINK

“Polymers : Infrared Linear Dichroism for the Analysis of Molecular Orientation in Polymers and in Polymer Composites” LINK

“Nearinfrared chemiluminescent carbon nanogels for oncology imaging and therapy” LINK

“Applied Sciences : Identification of Biochemical Differences in White and Brown Adipocytes Using FTIR Spectroscopy” LINK




Raman Spectroscopy

“Surface-Enhanced Raman Scattering Spectroscopy Combined With Chemical Imaging Analysis for Detecting Apple Valsa Canker at an Early Stage” | LINK

“Recent advances in background-free Raman scattering for bioanalysis” | LINK




Hyperspectral Imaging (HSI)

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

“Remote Sensing : Classification of Tree Species in Different Seasons and Regions Based on Leaf Hyperspectral Images” LINK

“Visible and Near-Infrared Hyperspectral Imaging (HSI) can reliably quantify CD3 and CD45 positive inflammatory cells in myocarditis: Pilot study on formalin-fixed …” LINK




Chemometrics and Machine Learning

“Molecules : Application of Transmission Raman Spectroscopy in Combination with Partial Least-Squares (PLS) for the Fast Quantification of Paracetamol” LINK

“Digital Assessment and Classification of Wine Faults Using a Low-Cost Electronic Nose, Near-Infrared Spectroscopy and Machine Learning Modelling” LINK

“Interpersonal Neural Synchronization Predicting Learning Outcomes From Teaching-Learning Interaction: A Meta-Analysis” | LINK

“Non-destructive near infrared spectroscopy externally validated using large number sets for creation of robust calibration models enabling prediction of apple firmness” LINK

“Sensors : Behavioural Classification of Cattle Using Neck-Mounted Accelerometer-Equipped Collars” LINK




Optics for Spectroscopy

“Physically Detachable and Operationally Stable Cs2SnI6 Photodetector Arrays Integrated with LEDs for Broadband Flexible Optical System” LINK




Facts

“A fast multi-source information fusion strategy based on deep learning for species identification of boletes” LINK




Research on Spectroscopy

“Reactivity between late first-row transition metal halides and the ligand bis (2-pyridylmethyl) disulfide: vibrantly-colored compounds with variable molecular …” LINK




Equipment for Spectroscopy

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




Environment NIR-Spectroscopy Application

“Remote Sensing : Comparing Sentinel-2 and WorldView-3 Imagery for Coastal Bottom Habitat Mapping in Atlantic Canada” LINK

“Soil water repellency prediction in high‐organic agricultural soils from Greenland: Comparing vis-NIRS to pedotransfer functions” LINK

“Remote Sensing : Simulation of Soil Organic Carbon Content Based on Laboratory Spectrum in the Three-Rivers Source Region of China” LINK

“Remote Sensing : Unmanned Aerial Vehicle (UAV)-Based Remote Sensing for Early-Stage Detection of Ganoderma” LINK

“Soil water repellency prediction in highorganic agricultural soils from Greenland: Comparing visNIRS to pedotransfer functions” LINK




Agriculture NIR-Spectroscopy Usage

“Assessing the nutritional quality of stored grain legume fodders: Correlations among farmers’ perceptions, sheep preferences, leaf-stem ratios and laboratory …” LINK

“Use of spectroscopic sensors in meat and livestock industries” LINK

“IJMS : Fourier-Transform Infra-Red Microspectroscopy Can Accurately Diagnose Colitis and Assess Severity of Inflammation” LINK

“Agronomy : Combining Variable Selection and Multiple Linear Regression for Soil Organic Matter and Total Nitrogen Estimation by DRIFT-MIR Spectroscopy” LINK

“Development of a Low-Cost Method for Quantifying Microplastics in Soils and Compost Using Near-Infrared Spectroscopy” LINK

“Applied Sciences : Optimization of Soybean Protein Extraction Using By-Products from NaCl Electrolysis as an Application of the Industrial Symbiosis Concept” LINK




Horticulture NIR-Spectroscopy Applications

“Nondestructive prediction of total soluble solids in strawberry using near infrared spectroscopy” LINK




Food & Feed Industry NIR Usage

“Effects of Irrigation Strategy and Plastic Film Mulching on Soil N2O Emissions and Fruit Yields of Greenhouse Tomato” LINK

“Making Cocoa Origin Traceable” LINK




Pharma Industry NIR Usage

“Microfluidic Synthesis of Block Copolymer Micelles: Application as Drug Nanocarriers and as Photothermal Transductors When Loading Pd Nanosheets” LINK




Other

“腔内影像学方法评价降脂治疗对冠状动脉粥样硬化斑块影响的研究进展” LINK

Electric scooter battery swap in Taiwan. LINK

“Resonance Couplings in Si@MoS<sub>2</sub> Core-Shell Architectures” LINK

“Relationship between the distribution of vegetation and the environment in the coastal embryo dunes of Jalisco, México” | LINK

“Consistency of children’s hemodynamic responses during spontaneous speech” | LINK