Cost comparision / Price comparison of Chemometrics / Machine Learning / Data Science for NIR-Spectroscopy

CalibrationModel.com (CM) versus Others

Costs are not everything, there are other important factors listed in the table.

CM fix € pricing Others € Price Range (approx.)
Software
included
Chemometric Package not‑needed
3500 – 6500 per user
Chemometric Predictor
free‑software
1500 – 2500 per NIR device
Knowledge
included
Chemometric Training not‑needed
1500 – 2500 per user
Chemometrician* Salary not‑needed
1 years Salary / year
(+ risk of Employee Turnover)
Computation
included
Powerful Computer (many Processors, lot of RAM for big data) not‑needed
1500 – 4500 per computer
Development and Usage
fix price
Development of a Calibration
299
80 – 150 / hour
of Chemometrician* using a Chemometric Software (click and wait) and applying it’s knowledge
Usage of a Calibration
299 / year
Total 598 in first year
299 in second year
initial (min 8000 , max 15500)
+ 2 * (2 – 4)(hour to cost same! as CM service) * (80 – 150) Chemometrician* work
no initial cost
very high initial costs
no personnel cost
high personnel* costs
constant CM services
risk of Employee Turnover
global knowledge
risk of only use personal knowledge
easy to calculate fix cost on demand
difficult to calculate variable cost on demand plus Chemometrician* Recruitment needed
Results :
calibration prediction performance
always reproducible highly optimized
only as good as your Chemometrician* daily condition
better prediction performance, due to best-of 10’000x calibrations
small size of experiments, non-optimal calibrations

Start Calibrate

*) Personnel / Chemometrician / Data Scientist / Data Analyst / Machine Learning Engineer : We are not against it, we are one of them a long time ago, but the way the work is done is changing (see below).

2019 Digitalization and the Future of Work: Macroeconomic Consequences
2019 The Digitalization of the American Workforce
2017 Digitalization and the American workforce , full-report

Spectroscopy and Chemometrics News Weekly #37, 2019

CalibrationModel.com

The new Version V2.4 of the free NIR-Predictor supports multiple native file formats of miniature, mobile and desktop spectrometers get your spectra analyzed as easy as Drag’n’Drop. LINK

Spectroscopy and Chemometrics News Weekly 36, 2019 | NIRS NIR Spectroscopy Chemometrics Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software Sensors QA QC Testing Quality Checking LINK

Spektroskopie und Chemometrie Neuigkeiten Wöchentlich 36, 2019 | NIRS NIR Spektroskopie Spektrometer Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse Qualitätslabor LINK

Spettroscopia e Chemiometria Weekly News 36, 2019 | NIRS NIR Spettroscopia Chemiometria analisi chimica Spettrale Spettrometro Chem Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem predictionmodel LINK




Chemometrics

“Identification of Passion Fruit Oil Adulteration by Chemometric Analysis of FTIR Spectra” LINK

“Investigating the use of visible and near infrared spectroscopy to predict sensory and texture attributes of beef M.longissimus thoracis et lumborum.” LINK

“Optimized prediction of sugar content in ‘Snow’ pear using near-infrared diffuse reflectance spectroscopy combined with chemometrics” LINK

“FT-NIR spectroscopy and multivariate classification strategies for the postharvest quality of green-fleshed kiwifruit varieties” FTNIR LINK

“An Approach to Rapid Determination of Tween-80 for the Quality Control of Traditional Chinese Medicine Injection by Partial Least Squares Regression in Near-Infrared Spectral Modeling” LINK

“Assessing macro-element content in vine leaves and grape berries of vitis vinifera by using near-infrared spectroscopy and chemometrics” LINK

“Investigating the use of visible and near infrared spectroscopy to predict sensory and texture attributes of beef M. longissimus thoracis et lumborum” LINK

“Rapid classification of commercial Cheddar cheeses from different brands using PLSDA, LDA and SPA-LDA models built by hyperspectral data” LINK




Near Infrared

“A Comparison of Sparse Partial Least Squares and Elastic Net in Wavelength Selection on NIR Spectroscopy Data.” LINK

“Reliability of NIRS portable device for measuring intercostal muscles oxygenation during exercise” LINK

“Ability of near-infrared spectroscopy for non-destructive detection of internal insect infestation in fruits: Meta-analysis of spectral ranges and optical measurement modes.” LINK

“Analysis of the Acid Detergent Fibre Content in Turnip Greens and Turnip Tops (Brassica rapa L. Subsp. rapa) by Means of Near-Infrared Reflectance.” LINK

“Lipid-Core Plaque Assessed by Near-Infrared Spectroscopy and Procedure Related Microvascular Injury.” LINK

“Analysis of the Acid Detergent Fibre Content in Turnip Greens and Turnip Tops (Brassica rapa L. Subsp. rapa) by Means of Near-Infrared Reflectance” Foods LINK

“Online monitoring of multiple component parameters during ethanol fermentation by near-infrared spectroscopy.” LINK




Hyperspectral

“Identifying Freshness of Spinach Leaves Stored at Different Temperatures Using Hyperspectral Imaging.” LINK

“Identifying Freshness of Spinach Leaves Stored at Different Temperatures Using Hyperspectral Imaging” Foods LINK




Equipment

“Investigations into the use of handheld near-infrared spectrometer and novel semi-automated data analysis for the determination of protein content in different cultivars of Panicum miliaceumL.” LINK




Agriculture

“Use of near-infrared spectroscopy for the rapid evaluation of soybean [Glycine max (L.) Merri.] water soluble protein content.” LINK




Food & Feed

“Rapid visible-near infrared (Vis-NIR) spectroscopic detection and quantification of unripe banana flour adulteration with wheat flour” LINK





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Spectroscopy and Chemometrics News Weekly #35, 2019

Near Infrared (NIR)

“Evaluation of diesel exhaust fluid (DEF) using near-infrared spectroscopy and multivariate calibration” LINK

“A weighted ensemble method based on wavelength selection for near-infrared spectroscopic calibration” LINK

“110th Anniversary: Real-Time Endpoint Detection of Fluidized Bed Drying Process Based on a Switching Model of Near-Infrared Spectroscopy” LINK

“Supervised Dictionary Learning with Regularization for Near-infrared Spectroscopy Classification” tobacco NIRS LINK

“Evaluation of NIRS as non-destructive test to evaluate quality traits of purple passion fruit” LINK

“A Comparison of Sparse Partial Least Squares and Elastic Net in Wavelength Selection on NIR Spectroscopy Data” LINK

“High-throughput analysis of leaf physiological and chemical traits with VIS-NIR-SWIR spectroscopy: a case study with a maize diversity panel.” LINK

“Comparative study on the use of three different near infrared spectroscopy recording methodologies for varietal discrimination of walnuts” LINK

“Support vector machine regression on selected wavelength regions for quantitative analysis of caffeine in tea leaves by near infrared spectroscopy” LINK

“Use of near infrared spectroscopy and spectral database to assess the quality of pharmaceutical products and aid characterization of unknown components” LINK

“Determination of soil organic matter using visible-near infrared spectroscopy and machinelearning” LINK

“Evaluation of acetic acid and ethanol concentration in a rice vinegar internal venturi injector bioreactor using Fourier transform near infrared spectroscopy” LINK




Chemometrics

“Determination of the superficial citral content on microparticles: An application of NIR spectroscopy coupled with chemometric tools” LINK

“Non-Invasive Tools to Detect Smoke Contamination in Grapevine Canopies, Berries and Wine: A Remote Sensing and Machine Learning Modeling Approach” LINK

“Optimization of soluble solids content prediction models in ‘Hami’melons by means of Vis-NIR spectroscopy and chemometric tools” LINK

“Fast quantitative detection of Black Pepper and Cumin adulterations by near-infrared spectroscopy and multivariate modeling” LINK

“Prediction of toughness and other beef quality characteristics of the m. longissimus thoracis using polarized near-infrared reflectance spectroscopy” LINK

“Application of near infrared for on-line monitoring of heavy fuel oil at thermoelectric power plants. Part I: Development of chemometric models” LINK

What’s a Near-Infrared-sensor for combines? Donau Soja collects data from soya fields for the soya yield- and protein prediction model within CYBELE_H2020. The NIR sensor measures & maps protein, oil and other quality parameters in real time during the upcoming harvest season! LINK

“NIRs calibration models for chemical composition and fatty acid families of raw and freeze-dried beef: a comparison” LINK

“Honey botanical origin classification using hyperspectral imaging and machine learning” LINK




CalibrationModel.com

Spectroscopy and Chemometrics News Weekly 34, 2019 | NIRS NIR Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Software Sensors QAQC Testing Quality Checking LabManagers laboratory digitalization LINK

Spektroskopie und Chemometrie Neuigkeiten Wöchentlich 34, 2019 | NIRS NIR Spektroskopie Chemometrie Spektrometer Sensor Nahinfrarot Chemie Analytik Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse Qualitätslabor labdata LINK

Spettroscopia e Chemiometria Weekly News 34, 2019 | NIRS NIR Spettroscopia Chemiometria analisi chimica Spettrale Spettrometro Chem Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem prediction models LINK




Facts

Most people now know companies like Google & Facebook collect & sell your data. Yet some people still think, “So what? I have nothing to hide.” Here’s five compelling reasons to tell them why your privacy is worth more than you think! LINK




Environment

“Relevance of a near infrared spectral index for assessing tillage and fertilization effects on soil water retention” LINK




Agriculture

“Fast And Simultaneous Prediction Of Agricultural Soil Nutrients Content Using Infrared Spectroscopy” LINK

“Quantitative and qualitative phenotyping of disease resistance of crops by hyperspectral sensors: seamless interlocking of phytopathology, sensors, and machine learning is needed!” LINK

“Prediction of macronutrients in plant leaves using chemometric analysis and wavelength selection” LINK




Other

“Spectroscopic data supporting investment decisions” LINK





.

Spectroscopy and Chemometrics News Weekly #32, 2019

CalibrationModel.com

Spectroscopy and Chemometrics News Weekly 31, 2019 | NIRS NIR Spectroscopy Chemometrics Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software Sensors QA QC Testing Quality Checking LINK

Spektroskopie und Chemometrie Neuigkeiten Wöchentlich 31, 2019 | NIRS NIR Spektroskopie Chemometrie Spektrometer Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysemethode Nahinfrarotspektroskopie Laboranalyse Qualitätslabor LINK

Spettroscopia e Chemiometria Weekly News 31, 2019 | NIRS NIR Spettroscopia Chemiometria analisi chimica Spettrale Spettrometro Chem Sensore analitica Laboratorio analisi prova qualità Analysesystem prediction models Calibrazione LINK




Chemometrics

“Near infrared spectroscopic investigation of lipid oxidation in model solid food systems” LINK

Rapid quantification of the adulteration of fresh coconut water by dilution and sugars using Raman spectroscopy and chemometrics, published in Food Chemistry, is now OpenAccess via LINK

“Recent Progress in Rapid Analyses of Vitamins, Phenolic, and Volatile Compounds in Foods Using Vibrational Spectroscopy Combined with Chemometrics: a Review” LINK

” Beef Tenderness Prediction by a Combination of Statistical Methods: Chemometrics and Supervised Learning to Manage Integrative Farm-To-Meat Continuum Data” Foods LINK

“P-Wave VisibleShortwaveNear-Infrared (Vis-SW-NIR) Detection System for the Prediction of Soluble Solids Content and Firmness on Wax Apples” LINK

“Model development for soluble solids and lycopene contents of cherry tomato at different temperatures using near-infrared spectroscopy” LINK




Near Infrared

“Preliminary Assessment of Visible, Near-Infrared, and Short-Wavelength-Infrared Spectroscopy with a Portable Instrument for the Detection of Staphylococcus aureus Biofilms on Surfaces.” LINK

” Inline monitoring of powder blend homogeneity in continuous drug manufacture using near infrared spectroscopy” LINK

“Nondestructive real-time assessment of sausage quality based on visible-near infrared spectrographic technique” LINK

“Lipid oxidation degree of pork meat during frozen storage investigated by near-infrared hyperspectral imaging: Effect of ice crystal growth and distribution” LINK

“High prevalence of cholesterol-rich atherosclerotic lesions in ancient mummies: A near-infrared spectroscopy study” LINK

“Application of Infrared Spectroscopy for Functional Compounds Evaluation in Olive Oil: A Current Snapshot” LINK

“Towards online Near-Infrared spectroscopy to optimise food product mixing” LINK




Hyperspectral

“Estimation of chlorophyll content in intertidal mangrove leaves with different thicknesses using hyperspectral data” LINK

“Snapshot Multispectral and Hyperspectral Data Processing for Estimating Food Quality Parameters” LINK




Environment

“Field Spectroscopy: A Non-Destructive Technique for Estimating Water Status in Vineyards” LINK

“Optical detection of contamination event in water distribution system using online Bayesian method with UVVis spectrometry” LINK




Agriculture

“GrassQ-A holistic precision grass measurement and analysis system to optimize pasture based livestock production” LINK

“Monitoring of Nitrogen and Grain Protein Content in Winter Wheat Based on Sentinel-2A Data” Remote Sensing LINK

“Identification and characterization of a fast-neutron-induced mutant with elevated seed protein content in soybean.” LINK

“Sensors, Vol. 19, Pages 3147: NIR Hyperspectral Imaging Technology Combined with Multivariate Methods to Study the Residues of Different Concentrations of Omethoate on Wheat Grain Surface” LINK




Food & Feed

“Multi-target Prediction of wheat flour quality parameters with near infrared spectroscopy” LINK




Other

” Spectroscopic determination of leaf chlorophyll content and color for genetic selection on Sassafras tzumu” LINK

Record-breaking new analytical method for fingerprinting petroleum and other complex mixtures LINK

A record-breaking 244,779 molecular compositions within a sample of petroleum have been assigned using a powerful method of analysing and ‘fingerprinting’ chemical mixtures developed by at . Read more: LINK

“Optical properties of living corals determined with diffuse reflectance spectroscopy” LINK





Spectroscopy and Chemometrics News Weekly #28, 2019

CalibrationModel.com

Why NIR vendors should use ready-to-use dedicated NIR modeling software solution that works already. LINK

Spectroscopy and Chemometrics News Weekly 27, 2019 | NIRS NIR Spectroscopy Chemometrics Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software Sensors QA QC Testing Quality Checking LINK

Spektroskopie und Chemometrie Neuigkeiten Wöchentlich 27, 2019 | NIRS NIR Spektroskopie Chemometrie Spektrometer Messtechnik Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Labor Analyse LINK

Spettroscopia e Chemiometria Weekly News 27, 2019 | NIRS NIR Spettroscopia Chemiometria analisi chimica Spettrale Spettrometro Chem Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem prediction models LINK

This week’s NIR news Weekly is sponsored by YourCompanyNameHere – BestNIRinstruments. Check out their product page … link

Get the Chemometrics and Spectroscopy News in real time on Twitter @ CalibModel and follow us.




Chemometrics

“Prediction of chemical content in patchouli oil (Pogostemon cablin Benth) by portable NIR spectroscopy” LINK

“Carbohydrate Analysis by NIRS-Chemometrics” LINK

“Chemosensors, Vol. 7, Pages 29: The Electronic Nose Coupled with Chemometric Tools for Discriminating the Quality of Black Tea Samples InSitu” LINK

fruit sensor calibration for monitoring fruit development continuously in the orchard see poster at ecpa2019 LINK

New Journal of Spectral Imaging–JSI Paper: Adaptive hierarchical clustering for hyperspectral image classification: Umbrella Clustering | Remotesensing LINK

“Prediction of Dissolution of Sustained Release Coated Ciprofloxacin Beads Using Near-infrared Spectroscopy and Process Parameters: a Data Fusion Approach” LINK




Near Infrared

“The effect of particle aspect ratio on spatially and angularly resolved vis-NIR spectroscopy of suspensions” LINK

nIRCat, a near-infrared (1000-1300 nm) probe to image dopamine in the brain LINK

“交通渋滞場面での怒りの接近動機づけ (攻撃性) における加齢の影響: 近赤外線分光法 (NIRS)・心拍出量・唾液中コルチゾールを用いた検討 (ヒューマンコミュニケーション基礎)” LINK

“Desarrollar un modelo de predicción mediante Espectroscopia en Infrarrojo Cercano (NIRS) para la determinación de proteína cruda en subproductos de arroz (Oriza sativa)” LINK

Detection of intracranial hematomas in the emergency department using near infrared spectroscopy LINK

Coating excipients How to Measure Coating Thickness of Tablets: Method Comparison of Optical Coherence Tomography, Near-infrared Spectroscopy and Weight-, Height- and Diameter Gain LINK

“NIRS identification of black textiles: Improvements for waste textiles sorting” LINK

“Near-infrared spectroscopy for determining the oxidation stability of diesel, biodiesel and their mixtures” LINK

“Influence of surface roughness and surface moisture of plastics on sensor-based sorting in the near infrared range.” LINK

“Present and future of portable/handheld near-infrared spectroscopy in chicken meat industry” LINK




Hyperspectral

“Remote Sensing, Vol. 11, Pages 1622: A Lightweight Hyperspectral Image Anomaly Detector for Real-Time Mission” LINK




Spectral Imaging

“Multispectral Imaging for Detection of Adulterants in Turmeric Powder” LINK




Facts

It’s hype nowadays to play with all the fancy shiny new open source releases, but how long will a company let their technicians play with it? LINK




Equipment

“Investigations into the use of handheld near-infrared spectrometer and novel semi-automated data analysis for the determination of protein content in different cultivars of Panicum miliaceum L.” LINK

“Extension of the Measurable Wavelength Range for a Near-Infrared Spectrometer Using a Plasmonic Au Grating on a Si Substrate” LINK




Process Control

“Integrated Robotic Mini Bioreactor Platform for Automated, Parallel Microbial Cultivation With Online Data Handling and Process Control” LINK




Agriculture

“Nutrients, Vol. 11, Pages 1476: Nutritional Properties and Consumers Acceptance of Provitamin A-Biofortified Amahewu Combined with Bambara (Vigna Subterranea) Flour” LINK

“Rapid detection of carbon-nitrogen ratio for anaerobic fermentation feedstocks using near-infrared spectroscopy combined with BiPLS and GSA” LINK




Forestry

“Soil C stocks in the sylvopastoral zone of Senegal as influences by trees” LINK




Medicinal

“Current methods for the assessment of skin microcirculation: Part 1” LINK




Other

“Kayseri Ekolojik Kosullarinda Farkli Ekim Zamanlarinin Nohut (Cicer arietinum L.) Bitkisinde verim, verim unsurlari ve kalite üzerine etkileri” LINK

“Seed composition of different Camelina sativa and Crambe abyssinica cultivars” LINK





Spectroscopy and Chemometrics News Weekly #27, 2019

CalibrationModel.com

Spektroskopie und Chemometrie Neuigkeiten Wöchentlich 26, 2019 | NIRS NIR Spektroskopie Chemometrie Spektrometer Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse LINK

Spectroscopy and Chemometrics News Weekly 26, 2019 | NIRS NIR Spectroscopy Chemometrics Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software Sensors QA QC Testing Quality Checking LINK

Spettroscopia e Chemiometria Weekly News 26, 2019 | NIRS NIR Spettroscopia Chemiometria analisi chimica Spettrale Spettrometro Chem Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem predictionmodels LINK

This week’s NIR news Weekly is sponsored by YourCompanyNameHere – BestNIRinstruments. Check out their product page … link

Get the Chemometrics and Spectroscopy News in real time on Twitter @ CalibModel and follow us.




Chemometrics

“Non-destructive Classification for Maturity of Pomelo CV. Tubtim Siam” Brix LINK

“Authentication of “Avola Almonds” by Near Infrared (NIR) Spectroscopy and chemometrics” LINK

“Feature selection based convolutional neural network pruning and its application in calibration modeling for NIR spectroscopy” LINK

” Geographical origin traceability of Cabernet Sauvignon wines based on Infrared fingerprint technology combined with chemometrics” LINK




Near Infrared

“Compositional Analysis of Cement Raw Meal by Near-Infrared (NIR) Spectroscopy” LINK

A joint project by researchers from and IMB_CNM will explore the possibility of developing silicon sensors for near-infrared light detection with single photon resolution funded by the LINK

“Molecular (Raman, NIR, and FTIR) spectroscopy and multivariate analysis in consumable products analysis” LINK

“Influences of Detection Position and Double Detection Regions on Determining Soluble Solids Content (SSC) for Apples Using On-line Visible/Near-Infrared (Vis/NIR) …” LINK

“Non-destructive determination of strawberry fruit and juice quality parameters using ultraviolet, visible, and near infrared spectroscopy” LINK

“Determination of API Gravity and Total and Basic Nitrogen Content by Mid-and Near-Infrared Spectroscopy in Crude Oil with Multivariate Regression and Variable Selection” LINK

“Selecting Near-infrared Hyperspectral Wavelengths Based on One-way ANOVA to Identify the Origin of Lycium Barbarum” LINK

“Rapid and Nondestructive Measurement of Rice Seed Vitality of Different Years Using Near-Infrared Hyperspectral Imaging.” LINK

“Rapid estimation of soil heavy metal nickel content based on optimized screening of near-infrared spectral bands” LINK

“Distinguishing watermelon maturity based on acoustic characteristics and near infrared spectroscopy fusion technology” LINK

“Development of a methodology to analyze leaves from Prunus dulcis varieties using near infrared spectroscopy” LINK

“Rapid fingerprinting technology of heavy oil spill by Mid-infrared spectroscopy” LINK

“Evaluation of high alcohol concentration using a 1.7-µm band near-infrared spectroscopy system using multi-mode optical fibers” LINK




Raman

“Journal Highlight: Raman Open Database: first interconnected RamanXray diffraction openaccess resource for material identification” LINK




Equipment

“Water as a probe for serum-based diagnosis by temperature-dependent near-infrared spectroscopy” LINK




Process Control

“Detecting special-cause variation ‘events’ from process data signatures” LINK




Environment

“Soil macrofauna and leaf functional traits drive the decomposition of secondary metabolites in leaf litter” LINK




Agriculture

“Plants, Vol. 8, Pages 205: Comparison of Sugar Profile between Leaves and Fruits of Blueberry and Strawberry Cultivars Grown in Organic and Integrated Production System” LINK

“Sensors, Vol. 19, Pages 2934: Combining Fourier Transform Mid-Infrared Spectroscopy with Chemometric Methods to Detect Adulterations in Milk Powder” LINK

“Utilising near-infrared hyperspectral imaging to detect low-level peanut powder contamination of whole wheat flour” LINK




Chemical

“All Donor Electrochromic Polymers Tunable across the Visible Spectrum via Random Copolymerization” LINK




Other

“Effet du moment d’acquisition des spectres proche infrarouge sur la qualité de prédiction du taux de lipides et du taux de fonte du foie gras chez le canard” LINK

“Investigation of the prevalence and characterisation of infection by Kudoa thyrsites and K. paniformis in South African marine fish species” LINK





Spectroscopy and Chemometrics News Weekly #26, 2019

CalibrationModel.com

NIR Method Development Service for Labs and NIR-Vendors (OEM) LINK

Spectroscopy and Chemometrics News Weekly 25, 2019 | NIRS NIR Spectroscopy Chemometrics Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software Sensors QA QC Testing Quality Checking LINK

Spektroskopie und Chemometrie Neuigkeiten Wöchentlich 25, 2019 | NIRS NIR Spektroskopie Chemometrie Spektrometer Sensoren Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Qualitätslabor LINK

Spettroscopia e Chemiometria Weekly News 25, 2019 | NIRS NIR Spettroscopia Chemiometria analisi chimica Spettrale Spettrometro Chem Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem prediction models LINK




Chemometrics

“X-ray fluorescence and visible near infrared sensor fusion for predicting soil chromium content” LINK

“Staling of white wheat bread crumb and effect of maltogenic a-amylases. Part 2: Monitoring the staling process by using near infrared spectroscopy and chemometrics” LINK

“Rapid and Nondestructive Quantification of Trimethylamine by FT-NIR Coupled with Chemometric Techniques” Fish quality LINK

“Prediction of yerba mate caffeine content using near infrared spectroscopy” LINK

“Journal Highlight: A new flow cell and chemometric protocol for implementing inline Raman spectroscopy in chromatography” LINK

Teaching Machine Learning at the moment and a student asks whether “PCA” stands for “Pretty Cool Algorithm” after I apparently used that phrase… That should really have been deliberate (it wasn’t). I will never use “Principal Component Analysis” again. PrettyCoolAlgorithm LINK

“A screening method based on Visible-NIR spectroscopy for the identification and quantification of different adulterants in high-quality honey.” LINK

“Chemometric studies of the effects of milk fat replacement with different proportions of vegetable oils in the formulation of fat-filled milk powders: Implications for quality assurance.” LINK

“Comparison of Bayesian and partial least squares regression methods for mid-infrared prediction of cheese-making properties in Montbéliarde cows” LINK

“NIR model transfer of alkali-soluble polysaccharides in Poria cocos with piecewise direct standardization” LINK

“Comparison of three different classification methods performance for the determination of biofuel quality by means of NIR spectroscopy” LINK

“Application of hierarchical classification models and reliability estimation by bootstrapping, for authentication and discrimination of wine vinegars by UV-vis spectroscopy” LINK

“Geographical origin traceability of Cabernet Sauvignon wines based on Infrared fingerprint technology combined with chemometrics.” LINK

“Determination of Adulteration Content in Extra Virgin Olive Oil Using FT-NIR Spectroscopy Combined with the BOSSPLS Algorithm” LINK




Near Infrared

“NIR-based Sudan I to IV and Para-Red food adulterants screening.” Paprika adulteration LINK

“Nondestructive detection of rape leaf chlorophyll level based on Vis-NIR spectroscopy.” LINK

“High-throughput analysis of leaf physiological and chemical traits with VIS–NIR–SWIR spectroscopy: a case study with a maize diversity panel” | New phenomics paper from Ge, Schnable, Sigmon and Yang labs of & LINK

High-throughput analysis of leaf physiological and chemical traits with VIS–NIR–SWIR spectroscopy: a case study with a maize diversity panel LINK

“Estimating dry matter and fat content in blocks of Swiss cheese during production using on-line near infrared spectroscopy” LINK

“Temperature-dependent near-infrared spectroscopy for studying the interactions in protein aqueous solutions” LINK

” 滑皮金桔糖度的近红外光谱无损检测技术.” “Non-destructive testing technology of sugar content in Huapikumquat by near infrared spectroscopy” LINK

“Grading and Sorting of Grape Berries Using Visible-Near Infrared Spectroscopy on the Basis of Multiple Inner Quality Parameters” LINK

“Modified silver nanoparticles enhanced single drop micro extraction of tartrazine in food samples coupled with diffuse reflectance Fourier transform infrared spectroscopic analysis” LINK

“Multicolor lanthanide-doped CaS and SrS near-infrared stimulated luminescent nanoparticles with bright emission: application in broad-spectrum lighting, information coding, and bio-imaging.” LINK

“The use of mid-infrared spectra to map genes affecting milk composition” |(19)30485-0/fulltext?rss=yes LINK




Raman

“Semi-Automated Heavy-Mineral Analysis by Raman Spectroscopy” Minerals LINK




Hyperspectral

“Discrimination of astringent and deastringed hard Rojo Brillante persimmon fruit using a sensory threshold by means of hyperspectral imaging” LINK

“Remote Sensing, Vol. 11, Pages 1485: Tensor Based Multiscale Low Rank Decomposition for Hyperspectral Images Dimensionality Reduction” LINK




Agriculture

“Applied Sciences, Vol. 9, Pages 2472: Comparison of Raman and Mid-Infrared Spectroscopy for Real-Time Monitoring of Yeast Fermentations: A Proof-of-Concept for Multi-Channel Photometric Sensors” LINK

“Agronomy, Vol. 9, Pages 293: Field Spectroscopy to Determine Nutritive Value Parameters of Individual Ryegrass Plants” LINK




Pharma

“Quantification of Inkjet-Printed Pharmaceuticals on Porous Substrates Using Raman Spectroscopy and Near-Infrared Spectroscopy” LINK




Laboratory

“Adapted-Consumer-Technology Approach to Making Near-Infrared-Reflectography Visualization of Paintings and Murals Accessible to a Wider Audience” – Journal of Chemical Education LINK





Spectroscopy and Chemometrics News Weekly #25, 2019

CalibrationModel.com

Spectroscopy and Chemometrics News Weekly 24, 2019 | NIRS NIR Spectroscopy Chemometrics Spectrometer Spectrometric Analytical Chemistry Chemical Analysis Lab Labs Laboratories Laboratory Software Sensors QA QC Testing Quality Checking LINK

Spektroskopie und Chemometrie Neuigkeiten Wöchentlich 24, 2019 | NIRS NIR Spektroskopie Chemometrie Spektrometer Sensor Nahinfrarot Chemie Analytik Analysengeräte Analysentechnik Analysemethode Nahinfrarotspektroskopie Laboranalyse LINK

Spettroscopia e Chemiometria Weekly News 24, 2019 | NIRS NIR Spettroscopia Chemiometria analisi chimica Spettrale Spettrometro Chem Sensore Attrezzatura analitica Laboratorio analisi prova qualità Analysesystem prediction models LINK




Chemometrics

“Classification of hybrid seeds using near-infrared hyperspectral imaging technology combined with deep learning” LINK

“Multivariate Discriminant Analysis of Single Seed Near Infrared Spectra for Sorting Dead-Filled and Viable Seeds of Three Pine Species: Does One Model Fit All Species?” forests LINK

“Development of near infrared spectroscopic methods to predict and understand dissolution of solid oral dosage forms” LINK

” Replication Data for: Towards a global arctic-alpine model for Near-infrared reflectance spectroscopy (NIRS) predictions of foliar nitrogen, phosphorus and …” LINK

” Genetic parameters for cow-specific digestibility predicted by near infrared reflectance spectroscopy” LINK

“Classification of Glycyrrhiza Seeds by Near Infrared Hyperspectral Imaging Technology” LINK

“Comprehensive comparison of multiple quantitative near-infrared spectroscopy models for Aspergillus flavus contamination detection in peanut.” LINK

“Non-Destructive Classification of Fruits Based on Vis-nir Spectroscopy and Principal Component Analysis” LINK




Near Infrared

“Assessment of applied microwave power of intermittent microwave-dried carrot powders from Colour and NIRS” LINK

“Soil Quality Analysis Using Modern Statistics and NIR spectroscopy Procedure” LINK

“Near-infrared diffusereflectance spectroscopy for discriminating fruit and vegetable products preserved in glass containers” LINK




Infrared

“A review of the application of near-infrared spectroscopy to rare traditional Chinese medicine” LINK

“Near-infrared spectroscopy as a tool for in vivo analysis of human muscles” LINK

“Surface Functionality and Water Adsorption Studies of a-Aluminium (III) Oxide Nanoparticles by near Infrared Spectroscopy” LINK

“A comparative study of mango solar drying methods by visible and near-infrared spectroscopy coupled with ANOVA-simultaneous component analysis (ASCA)” LINK

“High throughput phenotyping of Camelina sativa seeds for crude protein, total oil, and fatty acids profile by near infrared spectroscopy” LINK

“Near-infrared spectroscopic study of molecular interaction in ethanol-water mixtures” LINK




Hyperspectral

“Potential of hyperspectral imaging for nondestructive determination of chlorogenic acid content in Flos Lonicerae” LINK

“Thickness estimation of crude oil slicks by hyperspectral data based on partial least square regression method” LINK

“Development of a polarized hyperspectral imaging system for investigation of absorption and scattering properties” LINK

“Hyperspectral Imaging Retrieval Using MODIS Satellite Sensors Applied to Volcanic Ash Clouds Monitoring” LINK




Facts

“Sensor Fusion and Machine Learning for Soil Characterization from Farm to National Scale” LINK




Equipment

“Extension of the Measurable Wavelength Range for a Near-Infrared Spectrometer Using a Plasmonic Au Grating on a Si Substrate.” LINK




Environment

“Application of PROSPECT for estimating Total Petroleum Hydrocarbons in contaminated soils from leaf optical properties” LINK




Agriculture

“Ensemble Identification of Spectral Bands Related to Soil Organic Carbon Levels over an Agricultural Field in Southern Ontario, Canada” LINK

“Saving Old Bones: a non-destructive method for bone collagen prescreening” LINK

“Nondestructive On-site Detection of Soybean Contents Based on An Electrothermal MEMS Fourier Transform Spectrometer” LINK

“Remote Sensing Extraction of Crop Disaster Information Based on Support Vector Machine” LINK

“Remote Sensing, Vol. 11, Pages 1331: Evaluation of Leaf N Concentration in Winter Wheat Based on Discrete Wavelet Transform Analysis” LINK

“Predicting coefficient of linear extensibility and Atterberg limits of fine-grained soils using vis-NIR spectra” LINK




Other

“Effect of external compression on femoral retrograde shear and microvascular oxygenation in exercise trained and recreationally active young men” LINK





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Spectroscopy and Chemometrics News Weekly #22, 2019

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Chemometrics

“Comparison of rapid techniques for classification of ground meat” LINK

” Development of method for detection and quantification of foreign oils and fats in ghee (heat clarified milk fat) using FT NIR spectroscopy coupled with chemometric” LINK

“Impact of Fractional Calculus on Correlation Coefficient between Available Potassium and Spectrum Data in Ground Hyperspectral and Landsat 8 Image” LINK

“A Probabilistic Fusion of a Support Vector Machine and a Joint Sparsity Model for Hyperspectral Imagery Classification” LINK

“Spectral-Spatial Hyperspectral Image Classification Using Cascaded Convolutional Neural Networks” LINK

“Development of a predictive model for rapid detection of sulfur content in honeysuckle based on hyperspectral imaging technology.” LINK

“Improving colour rendering prediction with hyperspectral images”LINK

“Chemometric Approach Using ComDim and PLS-DA for Discrimination and Classification of Commercial Yerba Mate (Ilex paraguariensis St. Hil.)” LINK

“Calibration Transfer Based on Affine Invariance for NIR without Transfer Standards” LINK

Assessment of volatile fingerprint by HS-SPME/GC-qMS and E-nose for the classification of cocoa bean shells using chemometrics FoodChem LINK

“Radiometric Calibration of UAV Remote Sensing Image with Spectral Angle Constraint” RemoteSensing LINK

“From Academia to Reality Check: A Theoretical Framework on the Use of Chemometric in Food Sciences” LINK

“Multivariate predictive models for the prediction of fatty acids in the EU high added-value “acorn Iberian pig ham” using a miniature near-infrared spectroscopy instrument” LINK

“Establishing a predictive model for fast online determination of relative density and refractive index of e-cigarette liquids using near-infrared spectroscopy” | Tobacco ecigarette LINK

“Collaboration patterns and network in chemometrics” LINK




Near Infrared

“Measurement of SSC in processing tomatoes (Lycopersicon esculentum Mill.) by applying Vis‐NIR hyperspectral transmittance imaging and multi‐parameter …” LINK

“Non-destructive evaluation of Free Fatty Acid (FFA) of oil palm Fresh Fruit Bunch (FFB) using NIR spectroscopy.” LINK

“Fast discrimination of dedicated chemical fertilizer and pesticide applied in tobacco planting by using NIR spectra.” LINK

“NIR spectroscopic method for the detection of calcium carbide in artificial ripening of mangoes (Magnifera indica).” LINK

“近红外光谱桉树杂交种鉴别” “Application of NIRs for Discrimination of Eucalyptus Hybrids” LINK

“窗口竞争性自适应重加权采样策略的近红外特征变量选择方法” “A Variable Selection Approach of Near Infrared Spectra Based on Window Competitive Adaptive Reweighted Sampling Strategy” LINK


“Video-rate, mid-infrared hyperspectral upconversion imaging” LINK

“Visible Near Infrared Spectroscopy as a Green Technology: An Environmental Impact Comparative Study on Olive Oil Analyses” LINK

“Determination of saponins in Pien Tze Huang by near infrared spectroscopy.” LINK

“Identification of genetic variation in Brassica napus seeds for tocopherol content and composition using nearinfrared spectroscopy technique” LINK

“Photoacoustic Fourier Transform Near-and Mid-Infrared Spectroscopy for Measurement of Energy Levels of Electron Trapping Sites in Titanium (IV) Oxide Photocatalyst Powders” LINK




Hyperspectral

“Hyperspectral anomaly detection using spectral–spatial features based on the human visual system” LINK

“Hyperspectral imaging with a TWINS birefringent interferometer” LINK

” Using hyperspectral analysis as a potential high throughput phenotyping tool in GWAS for protein content of rice quality” LINK

“Use of Airborne Hyperspectral Datasets to Remotely Map a Siliciclastic Succession (Bresnahan Group, Australia)” LINK

” ABOVEGROUND BIOMASS ESTIMATION IN THE BRAZILIAN AMAZON USING COMBINED LIDAR AND HYPERSPECTRAL DATA” LINK

“Hyperspectral analysis of objects under shadow conditions based on field reflectance measurements” LINK

“Evaluation of lipid oxidation and volatile compounds of traditional dry‐cured pork belly: The hyperspectral imaging and multi‐gas‐sensory approaches” LINK

“Hyperspectral X-Ray Imaging for industrial NDT Applications” xray LINK




Facts

“Deep Learning For Feature Tracking In Optically Complex Waters” LINK




Equipment

“Overtones of νC≡ N Vibration as a Probe of Structure of Liquid CH3CN, CD3CN, and CCl3CN: Combined Infrared, Near-Infrared, and Raman Spectroscopic Studies …” LINK

“Investigation of Direct Model Transferability Using Miniature Near-Infrared Spectrometers.” LINK




Process Control

“Real-Time Monitoring of Particle Size Distribution in a Continuous Granulation and Drying Process by Near Infrared Spectroscopy” LINK




Environment

“The development and use of a quadcopter-mounted hyperspectral spectrometer for examining remote-sensing reflectance in Scottish coastal waters” LINK




Agriculture

“Nutritional and Microbiological Composition of Serra Estrela Cheese: A Paradigm to Overcome.” LINK

9th European Conference on Mineralogy and Spectroscopy September 11 — 13, 2019 Prague LINK

“Consumer insights on prepackaged Cheddar cheese shreds using focus groups, conjoint analysis, and qualitative multivariate analysis” LINK

“Moisture effects on robustness of sorghum grain protein NIR spectroscopy calibration” LINK

“Seasonal and diurnal relationship of forage nutritive value and mass in a tall fescue pasture under continuous stocking” LINK

“Comparison and Combination of Thermal, Fluorescence, and Hyperspectral Imaging for Monitoring Fusarium Head Blight of Wheat on Spikelet Scale” Sensors LINK




Laboratory

“Optical interpretation of oil emulsions in the ocean–Part I: Laboratory measurements and proof-of-concept with AVIRIS observations” LINK




Other

” Integrating Pure Pixel Identification into Nonnegative Matrix Factorization for Endmember Extraction” LINK

“Fire detection and temperature retrieval using EO-1 Hyperion data over selected Alaskan boreal forest fires” LINK

” Recent advances in emerging techniques for non-destructive detection of seed viability: A review” LINK

“Sensitivity of a Continuous Hot-Melt Extrusion and Strand Pelletization Line to Control Actions and Composition Variation” LINK

“Smartphone Coupled with a Paper-Based Colorimetric Device for Sensitive and Portable Mercury Ion Sensing” Chemosensors LINK

“Online measurement techniques for nanocellulose films and coatings” LINK





Spectroscopy and Chemometrics News Weekly #21, 2019

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Chemometrics

“Rapid Recognition of Geoherbalism and Authenticity of a Chinese Herb by Data Fusion of Near-Infrared Spectroscopy (NIR) and Mid-Infrared (MIR) Spectroscopy Combined with Chemometrics” LINK

“Quality Control Parameters in the Roasted Coffee Industry: a Proposal by Using MicroNIR Spectroscopy and Multivariate Calibration” LINK

“复烤片烟常规化学成分的傅里叶变换近红外光谱法的模型转移” “Model Transfer of Routine Chemical Components in Redried Lamina on Fourier Transform Near Infrared Spectroscopy” LINK

“Near-Infrared Spectroscopy for Non-Destructive Prediction of Maturity and Eating Quality of ‘Carabao’Mango (Mangifera indica L.) Fruit” LINK

“The feasibility study of non-destructive detection of cashmere by near-infrared spectroscopy and data driven-based class-modeling” LINK

“On a partial least squares regression model for asymmetric data with a chemical application in mining” LINK

“Optimizing genetic algorithmpartial least squares model of soluble solids content in Fukumoto navel orange based on visiblenearinfrared transmittance spectroscopy using discrete wavelet transform” LINK

“Correlation between the composition of green Arabica coffee beans and the sensory quality of coffee brews.” LINK

“Monitoring model for predicting maize grain moisture at the filling stage using NIRS and a small sample size” LINK

“Argan oil authentication using visible/near infrared spectroscopy combined to chemometrics tools” LINK




Near Infrared

“Quality evaluation of grapes for mechanical harvest using vis NIR spectroscopy” LINK

“FT-NIR spectroscopy coupled with multivariate analysis for detection of starch adulteration in turmeric powder” LINK

Is the gravimetric water content true? NIR spectroscopy gives an answer for polymers and composites – LINK

“Tissue Monitoring with Novel Broadband Light Emitting Diode-Based Near-Infrared Spectroscopy Device” LINK

“Effectiveness of 6-Ischemic Cuff Near Infrared Spectroscopy Mitochondrial Capactity Test” LINK

“Combining Visible− Near-Infrared and Pedotransfer Functions for Parameterization of Tile Drain Flow Simulations” LINK

“Rapid Determination of Chlorogenic Acid, Luteoloside and 3, 5-O-dicaffeoylquinic Acid in Chrysanthemum Using Near-Infrared Spectroscopy” LINK

“Nondestructive Determination and Visualization of Quality Attributes in Fresh and Dry Chrysanthemum morifolium Using Near-Infrared Hyperspectral Imaging” LINK

“Monitoring quality and safety assessment of summer squashes along the food supply chain using near infrared sensors” vegetable LINK




Raman

“Quantitation of trace amorphous solifenacin succinate in pharmaceutical formulations by transmission Raman spectroscopy.” LINK




Hyperspectral

“Estimation of paddy rice leaf area index using machine learning methods based on hyperspectral data from multi-year experiments.” LINK




Equipment

New post: New approach for fibre-based imaging spectrometer | imaging spectroscopy LINK

New product: PocketHawk compact 330–1050 nm spectrometer | UVVIS NIR spectroscopy LINK

New product: NIR MEMS spectrometer | MEMS NIR LINK




Process Control

“Improved solubility of asymmetric tetraethynylporphyrin derivatives for solution-processed organic solar cells” LINK




Agriculture

” ESTIMATION OF CATTLE AGE USING VISIBLE-NEAR-INFRARED SCANS OF HIDES” LINK




Medicinal

Understanding near infrared spectroscopy and its application to skeletal muscle research – new review article in LINK




Other

New product: Hitachi High-Tech Analytical Science launches new Vulcan+ LIBS range | LIBS LINK

“Winter and summer annual biotypes of camelina have different morphology and seed characteristics” LINK