M. Kuanar et Bk. Mishra, OPTIMIZATION OF A REGRESSION-MODEL FOR A QUANTITATIVE STRUCTURE - MUTAGENICITY RELATIONSHIP OF SOME NATURAL AMINO-ACIDS, Bulletin of the Chemical Society of Japan, 71(1), 1998, pp. 191-198
Multivariate statistical tools, such as principal-component analysis a
nd multiple-regression analysis, were used for a large number of struc
tural and empirical parameters of some eleven natural amino acids for
predicting mutagenicity. An optimized regression model was derived fro
m some selective principal components and solubility data. Plots relat
ed to the principal components resulted in the ordination of amino aci
ds as well as the structural and empirical parameters.