Keywords: Polycyclic aromatic hydrocarbons; MCR-ALS; EEMF: Random initialisation; Water samples; Chemometrics;
مقالات ISI (ترجمه نشده)
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Keywords: PCA; MCR-ALS; ICA; Semi-solid pharmaceutical formulations; Raman mapping;
Keywords: Antioxidants; DPPH; NIR; MCR-ALS; Factorial design;
Keywords: Solid-state characterization; Chemometrics; MIR; NIR; Raman and ssNMR spectroscopies; XRPD; Polymorph identification; Polymorphic transitions; PCA; MCR-ALS; PLS;
Keywords: Antiretroviral; pKa; Quantitation; FIA-DAD; MCR-ALS; Environmental samples;
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: Adulteration; Fingerprinting; Herbal slimming pills; GC-MS; MCR-ALS;
Keywords: Nitroaromatic compounds; MCR-ALS; Environmental water; High performance liquid chromatography-diode array detection;
Keywords: Tamoxifen; Drug photostability; UV spectroscopy; LC-DAD-MS; Fused data; MCR-ALS;
Keywords: DSC; Kinetic parameters; OFW methodology; MCR-ALS; Chemometry;
Keywords: MDMA; 3,4-methylenedioxymethamphetamine; MDAI; 5,6-methylenedioxy-2-aminoindane; API; active pharmaceutical ingredient; ANFO; ammonium nitrate fuel oil; ANN; artificial neural network; CTAB; cetyltrimethylammonium bromide; CCD; charge-coupled device; CCSW
Keywords: Mycophenolic acid; Corticosteroids; High performance liquid chromatography; Plasma; MCR-ALS;
Comparative multivariate curve resolution study in the area of feasible solutions
Keywords: Multivariate curve resolution; Nonnegative matrix factorization; Area of feasible solutions; MCR-ALS; ReactLab; FACPACK;
Multivariate curve resolution - Alternating least squares analysis of the total synchronous fluorescence spectra: An attempt to identify polyphenols contribution to the emission of apple juices
Keywords: MCR-ALS; Total antioxidant capacity; Total phenolic content; Total flavonoid content; Chemometrics;
A systematic study on the effect of noise and shift on multivariate figures of merit of second-order calibration algorithms
Keywords: Figures of merit; Second-order calibration; MCR-ALS; PARAFAC; Shift; Noise;
Applications of electrochemical data analysis by multivariate curve resolution-alternating least squares
Keywords: Chemometrics; Electrochemistry; MCR-ALS; Complexation; Quantification; Interaction; Resolution; Minimization of electrodic adsorption; MLR; multiple linear regression; KF; Kalman filter; PCA; principal component analysis; PCR; principal component regressi
Keywords: AAS; Atomic Absorption Spectrometry; ANN; Artificial Neural Networks; ARIMA; AutoRegressive Integrated Moving Average Modelling; ATR; Attenuated Total Reflectance; BP-ANN; Back Propagation Artificial Neural Networks; BRT; Boosted Regression Tree; CA; Clus
Keywords: Figures of merit; Comprehensive two-dimensional gas chromatography; Chemometrics; MCR-ALS; PARAFAC;
Keywords: Phosphate; Ferrihydrite; Goethite; Infrared spectroscopy; MCR-ALS; Desorption; Electrostatic interactions;
Keywords: Peak deconvolution; MCR-ALS; Constraints; Chemometrics; High-performance liquid chromatography (HPLC); Photo diode array detector (PDA);
Keywords: Nanoparticles concentration; Spectrophotometry; Chemometrics; MCR-ALS
Keywords: Piroxicam; Lactose; Dehydration; Solid dosage forms; Multi-series hyperspectral imaging; MCR-ALS;
Keywords: MCR-ALS; Green analytical chemistry; Simultaneous dissolution profiles
Keywords: Multivariate Curve Resolution-Alternating Least Squares; MCR-ALS; Comprehensive two-dimensional gas chromatography; Cannabis sativa; Cannabinoids; Sesquiterpenes;
Keywords: DOM; River-reservoir; Excitation and emission matrix fluorescence; MCR-ALS; PARAFAC; Fresh water system;
Keywords: Meso-tetraphenylporphyrin; Photodynamic Therapy; Plasma; Lipoprotein; Albumin; Hydrophobicity; HDL; high density lipoprotein; LDL; low density lipoprotein; HSA; human serum albumin (essentially fatty acid free); HSAlip; human serum albumin (not fatty acid
Monitoring anthocyanin degradation in Hibiscus sabdariffa extracts with multi-curve resolution on spectral measurement during storage
Keywords: MCR-ALS; Delphinidin-3-O-sambubioside; Cyanidin-3-O-sambubioside; Polyphenols; Degradation kinetics; Condensation;
Microheterogeneity in CH3OH/CD3OH mixture
Keywords: Binary mixtures; Methanol; Methanolâd3; Liquid phase; Molecular structure; Microheterogeneity; Hydrogen bonding; Spectroscopy; ATR-IR; NIR; 2D correlation analysis; Chemometrics; MCR-ALS; Excess spectra; DFT;
Continuous multicomponent quantification during supercritical fluid extraction applied to microalgae using in-line UV/Vis absorption spectroscopy and on-line evaporative light scattering detection
Keywords: BPR; back-pressure regulator; CLS; classical least squares; ELSD; evaporative light scattering detector; EFA; evolving factor analysis; MCR-ALS; multivariate curve resolution by alternating least squares; NRMSE; mean normalized root mean square error; PAR
Assessment of endocrine disruptors effects on zebrafish (Danio rerio) embryos by untargeted LC-HRMS metabolomic analysis
Keywords: AIF; All-ion fragmentation; BPA; Bisphenol A; CE-MS; Capillary electrophoresis-mass spectrometry; EDC; Endocrine disrupting chemical; GCâMS; Gas chromatography-mass spectrometry; HCA; Hierarchical cluster analysis; FTMS; Hybrid Fourier transform mass sp
Transient operando study on the NH3/NH4+ interplay in V-SCR monolithic catalysts
Keywords: V2O5-WO3/TiO2-sepiolite honeycomb; NH3-SCR; Operando FTIR; Acid sites; MCR-ALS;
MCR-ALS of hyperspectral images with spatio-spectral fuzzy clustering constraint
Keywords: Multivariate curve resolution; MCR-ALS; Clustering; Hyperspectral imaging; Spatial constraint;
Multicomponent inverse modeling of supercritical fluid extraction of carotenoids, chlorophyll A, ergosterol and lipids from microalgae
Keywords: CSTR; continuous stirred tank reactor; ELSD; evaporative light scattering detector; LHS; Latin hypercube sampling; MADS; mesh-adaptive direct search; MCR-ALS; multivariate curve resolution by alternating least squares; PR-EOS; Peng-Robinson Equation of St
A chemometric approach for characterization of serum transthyretin in familial amyloidotic polyneuropathy type I (FAP-I) by electrospray ionization-ion mobility mass spectrometry
Keywords: COW; correlation optimized warping; FAP-I; familial amyloidotic polyneuropathy type I; IM-MS; ion mobility mass spectrometry; IP; immunoprecipitation; LV; latent variable; MCR-ALS; multivariate curve resolution alternating least squares; Mr; relative mole
Data fusion applied to the photodegradation study of ciprofloxacin using hyphenated detection systems (UV-Vis and fluorescence) and multivariate curve resolution
Keywords: MCR-ALS; multivariate curve resolution-alternating least squares; UV; ultraviolet; F; fluorescence; HPLC; high performance liquid chromatography; HS-MCR; hard and soft multivariate curve resolution; CIP; ciprofloxacin hydrochloride; DAD; diode array detec
Mechanistic understanding and binding analysis of a novel Schiff base palladium (II) complex with β-lactoglobulin and human serum albumin
Keywords: Pd(II) complex; Molecular docking; MCR-ALS;
Detection of formaldehyde oxidation catalysis by MCR-ALS analysis of multiset ToF-SIMS data in positive and negative modes
Keywords: ToF-SIMS; Positive and negative modes; MCR-ALS; Multiset analysis; Formaldehyde; Catalysis; Birnessite;
MCR-ALS applied to the quantification of the 5-hydroxymethylfurfural using UV spectra: Study of catalytic process employing experimental design
Keywords: MCR-ALS; HPLC; Levulinic acid; UV spectroscopy; Niobic acid catalyst;
MCR-ALS and PLS coupled to NIR/MIR spectroscopies for quantification and identification of adulterant in biodiesel-diesel blends
Keywords: Biodiesel/diesel blends; Fuel adulteration; FT-MIR; FT-NIR; MCR-ALS; PLS;
Unveiling multiple solid-state transitions in pharmaceutical solid dosage forms using multi-series hyperspectral imaging and different curve resolution approaches
Keywords: Pharmaceuticals; Solid-state transitions; Infrared spectroscopy; Multi-series hyperspectral imaging; MCR-ALS; PARAFAC; PARAFAC2;
Knowledge integration strategies for untargeted metabolomics based on MCR-ALS analysis of CE-MS and LC-MS data
Keywords: Knowledge integration; Data fusion; Capillary electrophoresis-mass spectrometry; Liquid chromatography-mass spectrometry; MCR-ALS; Untargeted metabolomics; BGE; Background electrolyte; BSA; Bovine serum albumin; CMTF; Coupled matrix and tensor factorizati
Single pixel quantification strategies using middle infrared hyperspectral imaging of lignocellulosic fibers and MCR-ALS analysis
Keywords: Infrared imaging; MCR-ALS; Lignin; Cellulose; Pixel quantification; Concentration map;
Powerful combination of analytical and chemometric methods for the photodegradation of 5-Fluorouracil
Keywords: 5-Fluorouracil; Photodegradation; LC-DAD; LC-HRMS; MCR-ALS;
A comparative study on the effect of ionic liquid composition on the contributions of faradaic current in ionic liquid carbon paste electrodes by chemometrics method
Keywords: Carbon ionic liquid electrode; Faradaic current; Charging current; Chemometrics; MCR-ALS;
Three-point multivariate calibration models by correlation constrained MCR-ALS: A feasibility study for quantitative analysis of complex mixtures
Keywords: First-order calibration models; Partial Least Squares; MCR-ALS; Correlation constraint;
Near-infrared chemical imaging (NIR-CI) of 3D printed pharmaceuticals
Keywords: Hot-melt extrusion; Near-infrared chemical imaging; Multivariate data analysis; MCR-ALS; Patient-centered medicinal products;
Exploring the disruptive effects of TBT on lipid homeostasis of Daphnia magna using chemometric methods
Keywords: ASCA; MCR-ALS; Lipidomics; Daphnia magna; Ecotoxicology; Xenobiotic;
Chemometric analysis of comprehensive LC×LC-MS data: Resolution of triacylglycerol structural isomers in corn oil
Keywords: LC×LC-MS; Triacylglycerols; Structural isomers; Trilinearity; PARAFAC; MCR-ALS
Near infrared hyperspectral imaging and MCR-ALS applied for mapping chemical composition of the wood specie Swietenia Macrophylla King (Mahogany) at microscopic level
Keywords: NIR image spectroscopy; MCR-ALS; Cellulose; Extractives; Lignin; Concentration maps;
Data analysis strategies for targeted and untargeted LC-MS metabolomic studies: Overview and workflow
Keywords: Metabolomics; Data analysis; Mass spectrometry; Liquid chromatography; Target; Untarget; Chemometric tools; ABF; Analysis services backup file; ASCA; ANOVA-simultaneous component analysis; CART; Classification and regression trees; CAWG; Chemical analysis