Keywords: 1st D; (first derivative); 2nd D; (second derivative); ANN; (artificial neural networks); BP-MLP; (back-propagation multilayer perceptron); COE; (constant offset elimination); GFF; (generalized feed-forward); LVs; (latent variables); MMN; (min max normali
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Keywords: CSD; Cambridge Structural Database; FT-Raman; Fourier-transform Raman spectroscopy; LF-785; low-frequency Raman with 785Â nm excitation; LF-830; low-frequency Raman with 830Â nm excitation; PLSR; partial least squares regression; RMSEE; root-mean square e
Keywords: Forested peatland; Testate amoebae; Transfer function; Water table; James Bay lowlands; Replicates; CCA; canonical correspondence analysis; FB; forested bogs; FF; forested fen; FP; forested peatlands; OP; open non-forested peatlands; RMSEP; root mean squa
Keywords: NIR; near infrared spectroscopy; MIR; mid infrared spectroscopy; MLV; multilamellar vesicles; PCA; Principal Component Analysis; PC; principal component; nw; number of water molecules per lipid; nw´; steric number of water molecules per lipid; RMSEP; Roo
Keywords: AID; apparent ileal digestibility; Ca; calcium; NDF; neutral detergent fibre; P; phosphorus; NRC; National Research Council; R2; coefficient of determination RMSE root mean square error; RMSEP; root mean square error of prediction; Amino acids; Digestibil
Keywords: AV; acid value; ANN; Artificial Neural Networks; AnV; anisidine value; ATR; attenuated total reflectance; CARS; Competitive Adaptive Reweighted Sampling; DGF; German Society for Fat Science; DHA; docosahexaenoic acid; DTGS; deuterated triglycine sulfate;
Keywords: ALS; alternating least squares; API; active pharmaceutical ingredient; MCC; microcrystalline cellulose; MCR; multivariate curve resolution; NIR; near infrared; PEG; polyethylene glycol; PVA; polyvinyl alcohol; PAT; process analytical technology; PLS; proj
Keywords: 5α-adiol; 5α-androstan-3α,17β-diol; 5β-adiol; 5β-androstan-3α,17β-diol; A; androsterone; ANOVA; analysis of variance; AUC; area under the curve; CV%; coefficient of variation; CV; cross validation; DA; discriminant analysis; DHEA; dehydroepiandros
Keywords: LbL; layer-by-layer; OCC; old corrugated container; AFM; atomic force microscopy; SEM; scanning electron microscopy; RCT; ring crush test; RSM; response surface methodology; PEMs; polyelectrolyte multi-layers; CCD; central composite design; DDJ; Dynamic D
Keywords: ADF; acid detergent fibre; aNDF; neutral detergent fibre; CC; clover concentration; CP; crude protein; VCODM; volatile corrected oven dry matter; EDN; effective degradable nitrogen; EDDM; effective degradability of dry matter; EE; ether extract; FiM; Feed
Keywords: EIWO; Enhanced Invasive Weed Optimization; SD; Standard deviation; PAF; Percentage of affinity; RMSE-CV; Cross-validation root mean squared error; RMSEP; Prediction root mean squared error; PUCP; Percentage of un-correct prediction; PIFP; Powdered infant
Keywords: Aflatoxin; Aflatoxigenic fungus; Fluorescence; Near-infrared spectroscopy; Hyperspectral imaging; Rapid and non-destructive detection; A.; Aspergillus; AFB1; aflatoxin B1; AFB2; aflatoxin B2; AFG1; aflatoxin G1; AFG2; aflatoxin G2; ANN; artificial neural
Feasibility of the determination of three flavan-3-ols metabolites in urine samples via parallel factor analysis of fluorescence emission matrices
Keywords: 3-HPA; 3-hydroxyphenylacetic acid; 4-HPA; 4-hydroxyphenylacetic acid; EEM; excitation-emission matrices; LOD; limit of detention; PARAFAC; parallel factor analysis; RMSEP; root-mean-square error of prediction; SyA; syringic acid; 3-Hydroxyphenylacetic aci
Keywords: AA; amino acids; ADF; acid detergent lignin; AID; apparent ileal digestibility; CP; crude protein; CV; coefficient of variation; DDGS; dried distillers grains with solubles; EE; ether extract; NDF; neutral detergent fibre; R2; coefficient of determination
Keywords: DOC; dissolved organic carbon; OM; organic matter; TN; total nitrogen; PLS-R; partial least squares-regression; RMSEP; root mean square error of prediction; Compost; Biosolids; Hyperspectral spectroscopy; PLSR;
Keywords: n; Number of samples; PCA; Principal component analysis; PLS-R; Partial least squares regression; RMSEP; Root Mean Square Error in predicting validation; b; The regression coefficient at the cross validated given number of principle components using all t
Keywords: Agriculture; Agricultural products and food; Instruments; Laser-induced breakdown spectroscopy; Nutrient elements; Plants; Precision agriculture; Soil; Toxic metals; AAS; atomic absorption spectroscopy; ANN; artificial neural network; CF; calibration-free
Keywords: Forensic science; Comprehensive two-dimensional gas chromatography; Mass spectrometry; GCâÃâGC; GCâÃâGC-MS; Data analysis; Review; 1D; One dimensional; 2D; Two dimensional; 3D; Three dimensional; AAS; Atomic absorption spectrometry; ANOVA; Ana
Keywords: Chemometrics; Genetic epidemiology; Genome-wide association studies; Multivariate data; Multivariate regression technique; Partial least squares; Principal-component regression; Ridge regression; Single-nucleotide polymorphism; Statistical genetics; ASCA;
Keywords: DPV; differential pulse voltammetry; GCE; glassy carbon electrode; ACO; ant colony optimization; GA; genetic algorithm; SS; sample selection; PLS; partial least squares; MOP; morphine; NOP; noscapine; TEB; thebaine; COD; codeine; PAP; papaverine; HPLC-UV;
Keywords: ADME; Absorption Distribution Metabolism Excretion; ANNs; Artificial Neural Networks; log D; octanol/water distribution coefficient; log P; octanol/water partition coefficient; PAPMA; Parallel Artificial Membrane Permeability Assay; PCA; Principal Compo
Keywords: Sugar beet; Prediction; Model evaluation; Model comparison; RMSEP; Modelling efficiency
Keywords: LHS; Latin Hypercube Sampling; cLHS; conditioned Latin Hypercube Sampling; DLHS; D-Latin Hypercube Sampling; RMQS; French soil quality monitoring network; RMSEP; Root Mean Squared Error of Prediction; HF; harmonization function; RPD; ratio of standard dev
Keywords: MVC; multivariate calibration; PLS-1; partial least squares-1; CPR; continuum power regression; MLR; multiple linear regression; SPA; successive projections algorithm; RCR; robust continuum regression; PRM; partial robust M-regression; PLY-PLS; polynomial
Keywords: CEC; Cation Exchange Capacity; EDXRF; Energy-Dispersive X-ray Fluorescence; LV; Latent Variable; OM; Organic Matter; PC; Principal Component; PCA; Principal Component Analysis; PLSR; Partial Least Square Regression; RMSEC; Root Mean Square Error of Calibr
Evaluation of near-infrared (NIR) and Fourier transform mid-infrared (ATR-FT/MIR) spectroscopy techniques combined with chemometrics for the determination of crude protein and intestinal protein digestibility of wheat
Keywords: ATR-FT/MIR; attenuated total reflectance-Fourier transform mid-infrared spectroscopy; CP; crude protein; IR; infrared; IPD; intestinal protein digestibility; MIR; mid-infrared; NIR; near-infrared; PCA; principal component analysis; PLS; partial least squa
Identification of oil, sugar and crude fiber during tobacco (Nicotiana tabacum L.) seed development based on near infrared spectroscopy
Keywords: Tobacco seed; Seed development; Seed composition; Near infrared spectroscopy; 1st D; first derivate; LS-SVM; least-squares support vector machine; LVs; latent variables; MC-UVE; Monte Carlo uninformative variable elimination; MSC; multiplicative scatter c
Non-destructive prediction of 'Marsh' grapefruit susceptibility to postharvest rind pitting disorder using reflectance Vis/NIR spectroscopy
Keywords: RP; rind pitting; Vis/NIR; visible to near infrared radiation; PLS; partial least square; CI; chilling injury; RH; relative humidity; NIR; near infrared radiation; UV; ultraviolet; Chla; chlorophyll a; Chlb; chlorophyll b; Chla+b; total chlorophylls; Cx+c
Development of human biotransformation QSARs and application for PBT assessment refinement
Keywords: In vivo biotransformation; Biotransformation half-life; QSAR; Hazard assessment; Refined PBT assessment; 1-CoPK; one-compartment pharmacokinetic model; AD; Applicability Domain; ADME; Absorption, Distribution, Metabolism and Elimination; B; Bioaccumulati
Quality assessment and discrimination of intact white and red grapes from Vitis vinifera L. at five ripening stages by visible and near-infrared spectroscopy
Keywords: Vis/NIR; visible/nearinfrared; NIR; near-infrared; SSC; total soluble solid contents; TP; total phenolic compounds; MS; moving-average smoothing; SNV; standard normal variate; PLS; the partial least squares; LS-SVM; the least-squares support vector machin
Raman spectral imaging technique for API detection in pharmaceutical microtablets
Keywords: 2D; two-dimensional; 3D; three-dimensional; API; active pharmaceutical ingredient; CCD; charge-coupled device; HPLC; high performance liquid chromatography; LS-SVM; least-squares support vector machines; MCC; microcrystalline cellulose; MIR; mid-infrared;
Azodyn-Barley, a winter-barley crop model for predicting and ranking genotypic yield, grain protein and grain size in contrasting pedoclimatic conditions
Keywords: HI; high-input management; LNP; low-nitrogen and pesticides management; RMSEP; root mean square error of prediction; RRMSEP; Relative root mean square error of prediction; Hordeum vulgare L.; Grain protein content; Grain retention fraction; Parameter esti
Rapid and simultaneous analysis of five alkaloids in four parts of Coptidis Rhizoma by near-infrared spectroscopy
Keywords: 1st D; First Derivative; 2nd D; Second Derivative; BB; berberine; CO; coptisine; COE; Constant Offset Elimination; EP; epiberberine; JA; jatrorrhizine; LVs; the latent variables; MMN; Min Max Normalization; MSC; Multiplicative Scatter Correction; MSE; mea
Hyperspectral imaging for non-destructive prediction of fermentation index, polyphenol content and antioxidant activity in single cocoa beans
Keywords: AA; antioxidant activity; ABTS; 2,2â²-azino-bis(3-ethylbenzothiazoline-6-sulphonic acid; CV; coefficient of variation (%); DPPH; 2,2-diphenyl-1-picrylhydrazyl; FI; fermentation index; HSI; hyperspectral imaging; NIR; near-infrared; PLS; partial least squ
Novel spectrophotometric technique for rapid determination of extractable PHA using Sudan black dye
Keywords: PLSR; partial least square regression; LRA; linear regression analysis; MSM; minimal saline medium; PHA; poly(hydroxyalkanoate); RMSECV; root mean square error of cross-validation; RMSEP; root mean square error of prediction; RSE; residual standard error;
Intelligent evaluation of total volatile basic nitrogen (TVB-N) content in chicken meat by an improved multiple level data fusion model
Keywords: TVB-N; total volatile basic nitrogen; HSI; Hyperspectral Imaging; LLA; low-level data abstraction; ILA; intermediate level data abstraction; HLA; High-Level abstraction; MLF; multiple level data fusion; BP-ANN; back propagation- artificial neural network;
Detection and estimation of Super premium 95 gasoline adulteration with Premium 91 gasoline using new NIR spectroscopy combined with multivariate methods
Keywords: NIR; Near Infrared spectroscopy; PCA; Principle component analysis; PLS-DA; Partial least discriminant analysis; PLS; Partial least regression analysis; RMSE; Root mean square error; RMSECV; Root mean square error of cross validation; RMSEP; Root mean squ
Bridging the gap between ideotype and genotype: Challenges and prospects for modelling as exemplified by the case of adapting wheat (Triticum aestivum L.) phenology to climate change in France
Keywords: RMSEP; root mean square error of prediction; Wheat; Earliness; Stem extension; Marker-based model; Plasticity; Photoperiod sensitivity;
Improving the prediction of African savanna vegetation variables using time series of MODIS products
Keywords: AVHRR; advanced very high resolution radiometer; DPM; Disc Pasture Meter; EVI; Enhanced Vegetation Index; FPAR; Fraction of Photosynthetically Active Radiation; GIS; geographic information systems; LAI; Leaf Area Index; MODIS; Moderate Resolution Imaging
FT-NIRS coupled with chemometric methods as a rapid alternative tool for the detection & quantification of cow milk adulteration in camel milk samples
Keywords: FT-NIRS; fourier transform near-infrared spectroscopy; PLSDA; partial least squares discriminant analysis; PCA; principal component analysis; RMSECV; root mean square error of cross validation; RMSEP; root mean square error of prediction; PLS; partial lea
Identification and quantification of turkey meat adulteration in fresh, frozen-thawed and cooked minced beef by FT-NIR spectroscopy and chemometrics
Keywords: AUC; area under the ROC curve; AUCC; area under the ROC curve for calibration; AUCCV; area under the ROC curve for cross-validation; AUCP; area under the ROC curve for prediction; C; cooked meat samples; d1; first derivative; d2; second derivative; DNA; d
On-field monitoring of fruit ripening evolution and quality parameters in olive mutants using a portable NIR-AOTF device
Keywords: AOTF; Acousto Optically Tunable Filter; cv.; cultivar; DAD; diode-array detector; FLD; fluorescence detector; NIR; near infrared; PCA; Principal Component Analysis; PLS; Partial Least Square; RMSEC; Root Mean Standard error in Calibration; RMSECV; Root Me
Effect of sucrose concentration on the composition of enzymatically synthesized short-chain fructo-oligosaccharides as determined by FTIR and multivariate analysis
Keywords: FOS; fructo-oligosaccharides; DP; degree of polymerization; DP3; degree of polymerization equal to three; DP4; degree of polymerization equal to four; DP5; degree of polymerization equal to five; HPLC; high performance liquid chromatography; FTIR; Fourier
Fourier transform mid-infrared spectroscopy (FT-MIR) combined with chemometrics for quantitative analysis of dextrin in Danshen (Salvia miltiorrhiza) granule
Keywords: TCM; traditional Chinese medicines; GCM; granules of a Chinese medicine; WESY; water-soluble extract of single yinpian; WEDY; water-soluble extract of Danshen-yinpian; DG; Danshen granule; GCM-plus; each GCMs simply plus according to the prescription; NIR
Agrometeorological analysis and prediction of wheat yield at the departmental level in France
Keywords: RMSE; root mean square error; RMSEP; root mean square error of prediction; Wheat; Yield; Model; Cross-validation; Prediction; Agrometeorology;
A simple approach to predict growth stages in winter wheat (Triticum aestivum L.) combining prediction of a crop model and marker based prediction of the deviation to a reference cultivar: A case study in France
Keywords: Wheat; Earliness; Heading date; Beginning of stem elongation; Marker-based model; Association genetics; RMSEP; root mean square error of prediction;
Exploration of attenuated total reflectance mid-infrared spectroscopy and multivariate calibration to measure immunoglobulin G in human sera
Keywords: ATR; attenuated total reflectance; ELISA; enzyme-linked immunosorbent assay; IgG; immunoglobulin G; IR; infrared; PCA; principal component analysis; PP; projection pursuit; PLS; partial least squares; RID; radial immunodiffusion; RMMCCV; root mean Monte C
Total phosphorus reference condition for subalpine lakes: A comparison among traditional methods and a new process-based watershed approach
Keywords: Export coefficient models; Phosphorus; Reference conditions; Morpho Edaphic Index; MEI; Hydrological transport model; Diatom inferred TP; Chlorophyll inferred TP; HYDRO; Hydrological Transport model; MEI; Morpho Edaphic Index; TP; Total Phosphorus; ChlI-T
Implementation of an advanced hybrid MPC-PID control system using PAT tools into a direct compaction continuous pharmaceutical tablet manufacturing pilot plant
Keywords: QbD; quality by design; QbT; quality by testing; PAT; process analytical technology; MPC; model predictive control; PID; proportional integral derivative; PI; proportional integral; PCA; principal component analysis; NIR; near infrared; FDA; Food and Drug
The application of Near-Infrared Reflectance Spectroscopy (NIRS) to detect melamine adulteration of soya bean meal
Keywords: NIRS; Near Infrared Reflectance Spectroscopy; ELISA; Enzyme Linked Immunosorbent Assays; FPIA; Fluorescence Polarisation Immunoassay; SPR; Surface Plasmon Resonance; GC-MS; Gas-Chromatography Mass-Spectrometry; HPLC; High Performance Liquid Chromatograp