Analysis of the relationship between the structure and aromatic properties of chemical compounds.
This paper presents the results of research on the relationship between the structure and odour properties of a selection of chemical compounds. The research concerns five groups of esters, each with a different smell: almond, apricot, apple, pineapple and rose. The supposed relationship between the smell and certain selected attributes of each molecule was examined by various pattern recognition techniques using programs developed in the Department of Computer Chemistry at Rzeszów University of Technology.
Debska
Barbara
B
Department of Computer Chemistry, Rzeszów University of Technology, 6 Powstańców Warszawy Ave., 35041, Rzeszów, Poland. bjdebska@prz.rzeszow.pl
Guzowska-Swider
Barbara
B