Journal of Chemometrics

Papers
(The TQCC of Journal of Chemometrics is 2. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2021-09-01 to 2025-09-01.)
ArticleCitations
Determination of metal contents in aromatic herbs and spices from Algeria: Chemometric approach37
Detection the internal quality of watermelon seeds based on terahertz imaging technology combined with image smoothing and enhancement algorithm17
Chemometrics: A Vital Implement for Understanding the Water Structures by Near‐Infrared Spectroscopy16
Issue Information16
Minimum Spanning Tree‐Based Clustering for Chemical Evaluation of Commercial Nail Polish Samples Using Spectroanalytical Data15
The difference of model robustness assessment using cross‐validation and bootstrap methods15
Comprehensive Anomaly Score Rank Based Unsupervised Sample Selection Method14
Ensemble classification and regression techniques combined with portable near infrared spectroscopy for facile and rapid detection of water adulteration in bovine raw milk14
Robust Multivariate Dispersion Charts for Quality Control: Application to Sulfur Dioxide Monitoring13
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Data point importance: Information ranking in multivariate data12
Detection of talcum powder content in wheat flour by near infrared spectroscopy based on multilevel feature selection11
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A novel two‐phase near‐infrared and midinfrared wavelength selection framework for sample classification11
Principal Component Analysis: Standardisation11
Multi‐Block Chemometric Approaches to the Unsupervised Spectral Characterization of Geological Samples10
Alternative weighting schemes for fine‐tuned extended similarity indices10
Multimodal Stacked Modeling for Simultaneous Detection of Nutrient Concentrations With Turbidity Correction10
De Novo Design of HIV‐1 Integrase‐LEDGF/p75 Inhibitors Through Deep Reinforcement Learning and Virtual Screening10
Malt quality profile of barley predicted by near‐infrared spectroscopy using partial least squares, Bayesian regression, and artificial neural network models9
Issue Information9
Assessment of Conformal Prediction and Standard Normal Distribution for Autonomous Consensus One‐Class Classification8
ATR‐FTIR spectroscopy and chemometric complexity: unfolding the intra‐skeleton variability8
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Optimization total phenolic content and antioxidant activity of Saccocalyx satureioides extracts obtained by ultrasonic‐assisted extraction8
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A chemometrician's guide to transfer learning8
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Utilization of ultraviolet‐visible spectrophotometry in conjunction with wrapper method and correlated component regression for nitrite prediction outside the Beer–Lambert domain7
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Planetary and space science special issue7
A data‐driven soft sensor based on weighted probabilistic slow feature analysis for nonlinear dynamic chemical processes7
Three‐Way Data Reduction Based on Essential Information6
Being Aware of Data Leakage and Cross‐Validation Scaling in Chemometric Model Validation6
Issue Information6
Spectral Wavelength Selection Method Based on Improved Particle Swarm Optimization Idea and Simulated Annealing Strategy6
Benchtop NIR data standardization on handheld spectrometers to identify paracetamol tablets6
Two‐step hybrid modeling for variable selection and estimation: An application to quantitative structure activity relationship study6
Chemometrics as a tool for monitoring corrosion degradation of the selected alloys in real conditions6
Issue Information6
Green and Rapid Quantification of Ciprofloxacin Hydrochloride and Tylosin Tartrate in Veterinary Formulation using UV Spectrophotometric Method: A Comparative Study of Nature‐Inspired Algorithms for F5
Robust Multiplicative Scatter Correction Using Quantile Regression5
Efficient Wavelength Selection for Limited Near‐Infrared Spectral Data via Genetic Algorithm and Hybrid Regression5
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Multisource information fusion strategies of mass spectrometry and Fourier transform infrared spectroscopy data for authenticating the age and parts of Vietnamese ginseng5
Fast Partition‐Based Cross‐Validation With Centering and Scaling for XTX$$ {\mathbf{X}}^{\mathbf{T}}\mathbf{X} $$ and XTY$$ {\mathbf{X}}^{\mathbf{T}}\mathbf{Y} $$5
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Resampling as a Robust Measure of Model Complexity in PARAFAC Models5
A reliable algorithm for calculating stoichiometry parameters in the hard modeling of spectrophotometric titration data5
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Heavy metal content prediction based on Random Forest and Sparrow Search Algorithm5
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3D Fluorescence Spectroscopy Combined With Chemometrics as a Tool for Control of Imprinted Protein Purification From Template Molecules5
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Foreword for Special Issue Devoted to the 14th Winter Symposium on Chemometrics (2024)5
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Determination of active ingredients in alcohol‐based gel by spectroscopic techniques and chemometric analysis5
Decomposition of overlapping peaks in X‐ray fluorescence using improved crow searching algorithm based on opposite learning4
Feature Variable Selection for Near‐Infrared Spectroscopy Based on Simulated Annealing Bee Colony Algorithm4
Detection of skin defects in loquats based on grayscale features combined with reflectance, absorbance, and Kubelka–Munk spectra4
Accurate and Rational Collision Cross Section Prediction Using Voxel‐Projected Area and Deep Learning4
A Novel One‐Class Convolutional Autoencoder Combined With Excitation–Emission Matrix Fluorescence Spectroscopy for Authenticity Identification of Food4
Adaptive soft sensor modeling of chemical processes based on an improved just‐in‐time learning and random mapping partial least squares4
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Cell Culture Media and Raman Spectra Preprocessing Procedures Impact Glucose Chemometrics4
A synthetic review of some recent extensions of ComDim4
Origin of the OECD Principles for QSAR Validation and Their Role in Changing the QSAR Paradigm Worldwide: An Historical Overview4
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Characterisation of Position‐Dependant Ripening Dynamics of Nectarines Using Near‐Infrared Spectroscopy and ASCA4
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Expanding the Chemometric Data Analysis Toolbox With Immersive Analytics3
Partial least squares regression with multiple domains3
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Data‐analysis method for material optimization by forecasting long‐term chemical stability3
Experimental design optimization and isotherm modeling for removal of copper(II) by calcium‐terephthalate MOF synthesized from recycled PET waste3
Can One Recover the Underlying Spectral Data Matrix From a Given Borgen Plot?3
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XAI‐2DCOS: Enhancing Interpretability in Spectral Deep Learning Models Through 2D Correlation Spectroscopy3
Quantitative Structure–Activity Relationship Modeling Based on Improving Kernel Ridge Regression3
Sample selection method using near‐infrared spectral information entropy as similarity criterion for constructing and updating peach firmness and soluble solids content prediction models3
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Who is winning? A comparison of humans versus computers for calibration model building3
A tutorial on the analysis of multifactorial designs from one or more data sources using AComDim3
Introduction to statistical, algorithmic and theoretical basis of principal components analysis3
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Optimized extraction of Pb (II) and Co (II) with glycolamide mono and di‐ionic liquids using response surface methodology3
Past, Present and Future of Research in Analytical Figures of Merit3
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Nonparametric Threshold Estimation of Autocorrelated Statistics in Multivariate Statistical Process Monitoring2
Application of ATR‐FTIR Spectrum Combined With Ensemble Learning and Deep Learning for Identification of Amomum tsao‐ko at Different Drying Temperatures2
A chemometrician's guide to transfer learning2
Swiss knife covariates selection: A unified algorithm for covariates selection in single block, multiblock, multiway, multiway multiblock cases including multiple responses2
Comprehensive multivariate evaluation of the effects on cell phenotypes in multicolor flow cytometry data using ANOVA simultaneous component analysis2
Novel Sexalinear Decomposition Algorithm for Analyzing the Chemical Sexalinear Data Array2
limpca: An R package for the linear modeling of high‐dimensional designed data based on ASCA/APCA family of methods2
Next‐Gen Crop Monitoring: MTEG‐RTU Algorithm and UAV Synergy for Precise Disease Diagnosis2
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A brief note on a new faster covariate's selection (fCovSel) algorithm2
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Application of chemometrics on Raman spectra from Mars: Recent advances and future perspectives2
Enhanced Discrimination of Thawed and Nonfrozen Chicken Thighs Using Convex Hull Peeling in Visible Spectral Imaging2
On a black hole effect in bilinear curve resolution based on least squares2
Automatic pretreatment and multiblock analysis of flavor release and sensory temporal data simultaneously collected in vivo2
Iterative re‐weighted covariates selection for robust feature selection modelling in the presence of outliers (irCovSel)2
Influence of a Measurement Procedure and Evaluation of Transflectance Sensing System for Quantifying Sunflower Oil Adulterations in Olive Oil. A Proof of Concept2
Image‐based characterization of flocculation processes through PLS inspired representation learning in convolutional neural networks2
Issue Information2
An antioxidative potential‐based comparison of different peanut extraction methods, optimized through response surface methodology2
Deep Information Retention Network‐Enabled Data Modeling for Key Quality Indicator Prediction in the Chemical Industry2
Performance enhancement‐based active learning sample selection method2
Unlocking New Capabilities in the Analysis of GC × GC‐TOFMS Data With Shift‐Invariant Multi‐Linearity2
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ASER: Adapted squared error relevance for rare cases prediction in imbalanced regression2
Methodologies based on ASCA to elucidate the influence of a subprocess: Vinification as a case of study2
Implications of confounding from unmodeled interactions between explanatory variables when using latent variable regression models to make inferences2
Remembering Prof. Edmund R. Malinowski, 1932–2020 Professor of Chemistry, 1963–1997 Stevens Institute of Technology2
A dynamic sample augmentation Kriging metamodeling method for industrial residue hydrogenation process2
Smart Monitoring Solutions for Real‐Time Water pH Regulation in Aquatic Ecotoxicology2
Automatic peak annotation and area estimation of glycan map peaks directly from chromatograms2
Spatial–Temporal Deviation Analysis for Multivariate Statistical Process Monitoring2
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Infrared Spectroscopy and Machine Learning for Classification of Red Stamp Inks on Questioned Documents2
On the Replicability of the Thermodynamic Modeling of Spectroscopic Titration Data in the Nickel(II) En System2
Toward more efficient and effective color quality control for the large‐scale offset printing process2
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