Chemometrics and Intelligent Laboratory Systems

Title Publication Date Language Citations
Principal component analysis of multivariate images1989/03/01English128
DD-SIMCA – A MATLAB GUI tool for data driven SIMCA approach2017/08/01English128
Moving window kernel PCA for adaptive monitoring of nonlinear processes2009/04/01English128
A wavelength selection method based on randomization test for near-infrared spectral analysis2009/07/01English124
Algorithms for Projection–Pursuit robust principal component analysis2007/06/01English121
Waveband selection for NIR spectroscopy analysis of soil organic matter based on SG smoothing and MWPLS methods2011/05/01English120
Method and model comparison by sum of ranking differences in cases of repeated observations (ties)2013/08/01English120
Stability competitive adaptive reweighted sampling (SCARS) and its applications to multivariate calibration of NIR spectra2012/03/01English118
Rigorous and compliant approaches to one-class classification2016/12/01English118
How important is to detect systematic error in predictions and understand statistical applicability domain of QSAR models?2017/03/01English118
Estimation of total carbohydrate amount in environmental samples by the phenol–sulphuric acid method assisted by multivariate calibration2005/10/01English117
Fault diagnosis of Tennessee Eastman process with multi-scale PCA and ANFIS2013/01/01English117
On the calibration of sensor arrays for pattern recognition using the minimal number of experiments2014/01/01English114
Gaussian process regression for multivariate spectroscopic calibration2007/05/01English114
“NanoBRIDGES” software: Open access tools to perform QSAR and nano-QSAR modeling2015/10/01English114
Fault detection in the Tennessee Eastman benchmark process using dynamic principal components analysis based on decorrelated residuals (DPCA-DR)2013/06/01English113
Chemical information of Chinese medicines: A challenge to chemist2006/05/01English112
Improvement of the piecewise direct standardisation procedure for the transfer of NIR spectra for multivariate calibration1996/03/01English111
Use of FT-NIR spectrometry in non-invasive measurements of soluble solid contents (SSC) of ‘Fuji’ apple based on different PLS models2007/05/01English111
Fluorescence spectroscopy and PARAFAC in the analysis of yogurt2005/02/01English109
Improving hierarchical cluster analysis: A new method with outlier detection and automatic clustering2007/06/01English108
Artificial intelligence-based single and hybrid models for prediction of water quality in rivers: A review2020/05/01English108
A performance comparison of modern statistical techniques for molecular descriptor selection and retention prediction in chromatographic QSRR studies2005/04/01English107
Data handling in hyperspectral image analysis2011/08/01English106
Strategy of multivariate image analysis (MIA)1989/12/01English105
Algorithms and tools for the preprocessing of LC–MS metabolomics data2011/08/01English105
A general approach to derivative calculation using wavelet transform2003/11/01English105
Kernel PLS regression on wavelet transformed NIR spectra for prediction of sugar content of apple2007/02/01English105
An automated Residual Exemplar Local Binary Pattern and iterative ReliefF based COVID-19 detection method using chest X-ray image2020/08/01English105
Tensors-structured numerical methods in scientific computing: Survey on recent advances2012/01/01English105