Chemometrics and Intelligent Laboratory Systems

Title Publication Date Language Citations
Principal component analysis1987/08/01English6,701
Performance of some variable selection methods when multicollinearity is present2005/07/01English1,381
A review of variable selection methods in Partial Least Squares Regression2012/08/01English1,085
Disturbance detection and isolation by dynamic principal component analysis1995/11/01English922
A graphical user-friendly interface for MCR-ALS: a new tool for multivariate curve resolution in MATLAB2005/03/01English892
Particle swarm optimization (PSO). A tutorial2015/12/01English701
MCR-ALS GUI 2.0: New features and applications2015/01/01English580
Multi-way partial least squares in monitoring batch processes1995/11/01English514
zCompositions — R package for multivariate imputation of left-censored data under a compositional approach2015/04/01English505
On a simple approach for determining applicability domain of QSAR models2015/07/01English502
Be aware of error measures. Further studies on validation of predictive QSAR models2016/03/01English501
Process analysis, monitoring and diagnosis, using multivariate projection methods1995/04/01English484
Further exploring rm2 metrics for validation of QSPR models2011/05/01English446
Review on data-driven modeling and monitoring for plant-wide industrial processes2017/12/01English433
A variable selection method based on uninformative variable elimination for multivariate calibration of near-infrared spectra2008/02/01English420
Analysis of variance (ANOVA)1989/11/01English366
Image texture analysis: methods and comparisons2004/06/01English317
Recursive feature elimination with random forest for PTR-MS analysis of agroindustrial products2006/09/01English316
Fault detection and identification of nonlinear processes based on kernel PCA2005/01/01English304
Application of LS-SVM to non-linear phenomena in NIR spectroscopy: development of a robust and portable sensor for acidity prediction in grapes2004/05/01English279
Comparing support vector machines to PLS for spectral regression applications2004/10/01English278
Scalable tensor factorizations for incomplete data2011/03/01English275
Desirability function approach: A review and performance evaluation in adverse conditions2011/07/01English274
LIBRA: a MATLAB library for robust analysis2005/02/01English266
Support vector machines and its applications in chemistry2009/02/01English259
Receiver operating characteristics curves and related decision measures: A tutorial2006/01/01English246
Spectral pre-processing for biomedical vibrational spectroscopy and microspectroscopic imaging2012/08/01English234
Exploring the impact of size of training sets for the development of predictive QSAR models2008/01/01English230
Analysis of two partial-least-squares algorithms for multivariate calibration1987/08/01English228
ParLeS: Software for chemometric analysis of spectroscopic data2008/01/01English221