ChemoSpec (1.48-4)

Exploratory Chemometrics for Spectroscopy.

http://academic.depauw.edu/~hanson/ChemoSpec/ChemoSpec.html
http://cran.r-project.org/web/packages/ChemoSpec

A collection of functions for plotting spectra (NMR, IR etc) and carrying out various forms of top-down exploratory data analysis, such as HCA, PCA and model-based clustering. The design allows comparison of data from samples which fall into groups such as treatment vs. control. Robust methods appropriate for this type of high-dimensional data are available. ChemoSpec is designed to be very user friendly and suitable for people with limited background in R.

Maintainer: Bryan A. Hanson
Author(s): Bryan A. Hanson DePauw University, Greencastle Indiana USA

License: GPL-3

Uses: amap, chemometrics, lattice, MASS, mclust, mvbutils, mvoutlier, mvtnorm, pcaPP, pls, plyr, R.utils, RColorBrewer, rgl, robustbase, seriation, rggobi

Released about 3 years ago.