| Chemometrics for comprehensive GC/LC-MS data evaluation
Comprehensive data evaluation means that we try to squeeze out all information from our raw data - with every possible approach - [e] Chemometrics Toolbox
... provides more than 40 specialized MATLAB functions for chemometric calibration. Mathworks - [e] Extract
... is designed to help visualize the structure and quantitative relationships in your data - [e] Factor Analysis Toolbox for MATLAB
... provides a family of specialized MATLAB functions for factor analysis techniques - [e] GOLPE
GOLPE (Generating Optimal Linear PLS Estimations) is the state of the art chemometric toolbox for 3D QSAR - [e] Mathtools Chemometrics
List of matlab tools - [e] Mathtools Chemometrics Excel
List of microsoft excel tools - [e] Multi-Qual
... enables you to calibrate spectrometers to perform Chemometric (multiwavelength) qualitative chemical analysis using Mahalanobis mathematics - [e] Multi-Quant
... enables you to calibrate spectrometers to perform Chemometric (multiwavelength) quantitative chemical analysis using Least Squares Multiple Regression mathematics (MLR) - [e] MultiSimplex
A powerful tool for design of experiments and optimization. Grabitech - [e] ParLeS
Executable software for chemometric analysis of spectroscopic data - [e] Pirouette
Prediction, classification, data exploration and pattern recognition methods are implemented in a single program. Infometrix - [e] Pirouette Lite
Prediction, classification, data exploration and pattern recognition methods are implemented in a single program. Infometrix - [e] PLSplus/IQ
... includes multivariate analysis tools for building quantitative calibrations as well as qualitative models for discriminant analysis. Thermo Fisher Scientific Inc. - [e] SIMCA
A state-of-the-art suite of software products for data analysis. Umetrics - [e] SIRIUS
... is a tool for multivariate analysis that covers all the central methods within multivariate exploratory analysis, classification/discrimination and calibration/response modeling. Pattern Recognition Systems, PRS - [e] SOM Toolbox
... is a function package for Matlab 5 implementing the Self-Organizing Map (SOM) algorithm and more - [e] Unscrambler
The Unscrambler is the complete Multivariate Analysis and Experimental Design software, equipped with powerful methods including PCA, Multivariate Curve Resolution (MCR), PLS regression, 3-Way PLS regression, Clustering (K-Means), SIMCA and PLS-DA Classification etc.. Camo - [e] Xtricator
... is a software product that is developed for quantitative and qualitative analysis of data from analytical instruments as HPLC-DAD, GC-IR, GC-MS , FTIR excitation-emission spectroscopy, etc.. Pattern Recognition Systems, PRS - [e] | 
