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Similarity studies using statistical and genetical methods
Authors:Dorota Bielińska-W??  Piotr W??  Subhash C Basak
Institution:(1) Instytut Fizyki, Uniwersytet Mikołaja Kopernika, Grudziądzka 5, 87-100 Toruń, Poland;(2) Centrum Astronomii, Uniwersytet Mikołaja Kopernika, Gagarina 11, 87-100 Toruń, Poland;(3) Natural Resources Research Institute, 5013 Miller Trunk Highway, Duluth, MN 55811-1442, USA
Abstract:This paper aims at demonstrating the applicability of statistical spectroscopy and genetic algorithms to the similarity studies. Statistical moments of the intensity distributions are used as a basis for defining similarity distances between pairs of model spectra. Model spectrum is taken as a sum of two Gaussian distributions characterized by different parameters. As a result, dissimilarity maps are presented.
Keywords:data mining  statistical theory of spectra  molecular similarity  genetic algorithms
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