Chemometrics in analytical chemistry—part II: modeling, validation, and applications

Handling Different Spatial Resolutions in Image Fusion by Multivariate Curve Resolution-Alternating Least Squares for Incomplete Image Multisets

(2018) Sara Piqueras et al.   ANALYTICAL CHEMISTRY

Big (Bio)Chemical Data Mining Using Chemometric Methods: A Need for Chemists

(2018) Roma Tauler et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Relevant aspects of unmixing/resolution analysis for the interpretation of biological vibrational hyperspectral images

(2017) Víctor Olmos et al.   TRAC-TRENDS IN ANALYTICAL CHEMISTRY

Compression strategies for the chemometric analysis of mass spectrometry imaging data

(2016) Carmen Bedia et al.   JOURNAL OF CHEMOMETRICS

Data analysis strategies for targeted and untargeted LC-MS metabolomic studies: Overview and workflow

(2016) Eva Gorrochategui et al.   TRAC-TRENDS IN ANALYTICAL CHEMISTRY

Validation of chemometric models – A tutorial

(2015) Frank Westad et al.   ANALYTICA CHIMICA ACTA

Vibrational spectroscopic image analysis of biological material using multivariate curve resolution–alternating least squares (MCR-ALS)

(2015) Judith Felten et al.   Nature Protocols

Non-linear calibration models for near infrared spectroscopy

(2013) Wangdong Ni et al.   ANALYTICA CHIMICA ACTA

Concept and role of extreme objects in PCA/SIMCA

(2013) Alexey L. Pomerantsev et al.   JOURNAL OF CHEMOMETRICS

One-class classifiers

(2011) Richard G. Brereton   JOURNAL OF CHEMOMETRICS

A tutorial on support vector machine-based methods for classification problems in chemometrics

(2010) Jan Luts et al.   ANALYTICA CHIMICA ACTA