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J Mol Model ; 10(5-6): 335-41, 2004 Dec.
Article in English | MEDLINE | ID: mdl-15597202

ABSTRACT

Fuzzy logic has been used as a tool in structure-camphoraceous odor relationships. The data base studied included 99 molecules. The rules used to discriminate between camphor and non camphor molecules lead to 77% correct discrimination. Such rules account for the shape and the size of the molecule. Their adjustment by means of genetic algorithms led to 84% correct discrimination between camphor and non-camphor molecules. [figure: see text]. Membership function for the chosen variables.


Subject(s)
Algorithms , Camphor/chemistry , Classification/methods , Fuzzy Logic , Models, Molecular , Odorants , Camphor/classification , Models, Genetic , Structure-Activity Relationship
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