Application Notes

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Design of Experiments

Cake Mix (2 pages, 237 kB pdf).
Using MODDE for design of experiments.


Efficient HPLC Validation (2 pages, pdf).
Using MODDE for design of experiments.



Improving a Biological Assay (2 pages, pdf).
Using MODDE for design of experiments.



 RED-MUP Designs for Multiwell Plates (5 pages, pdf).
Presentation of a new set of designs for Multiwell technology



Multivariate Data Analysis

Drug Permeability (2 pages, 368 kB pdf).
Using SIMCA-P for multivariate data analysis of pharmaceutical data



Gene Expression Data (2 pages, 304 kB pdf).
Using SIMCA-P for multivariate data analysis of biomedical data



Designing a Better Detergent (2 page, 125 kB pdf).
Using SIMCA-P for multivariate data analysis of QSAR data



Data Mining with SIMCA-P and MODDE (2 pages, pdf).
Using SIMCA-P for multivariate data analysis.


Metabonomics (4 pages, pdf).
Using SIMCA-P+ for multivariate data analysis.



A Strategy for Informatics (2 pages, pdf).
Using SIMCA-P+ for multivariate data analysis.



Statistical Molecular Design (7 pages, pdf).
Using SIMCA-P for multivariate data analysis.



Spectroscopic Calibration (2 pages, pdf).
Using SIMCA-P for multivariate data analysis.



Analysing Omics Data (2 pages, pdf).
Using SIMCA-P+ for multivariate data analysis.


Mass Spec Based Metabonomics (3 pages, pdf).
Using SIMCA-P+ for multivariate data analysis.


Chemical Maps using SIMCA-P (3 pages, pdf).
Using SIMCA-P for multivariate data analysis.



A Multivariate QSAR Model for CyP450 (3 pages, pdf).
Using SIMCA-P for multivariate data analysis.


Target Directed Filtering
Hierarchical multivariate modelling as a tool for
target directed filtering of process data (2005)
TDF-Poster (220 kB pdf).



MACI
Multivariate Analysis of Congruent Images (2005)
MACI-Poster (330 kB pdf).



OPLS (Orthogonal PLS)
Separating predictive from non-predictive variation in QSAR, predictive toxicology and “Omics”-data analysis (2005)
OPLS-Poster (392 kB pdf).



Onion Design
A novel tool maximizing molecular diversity (2004)
OD-Poster (595 kB pdf).