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Calculation of the information content of retrieval procedures applied to mass spectral data bases
Authors:Geert Van Marlen  Auke Dijkstra  Henk A Van&#x;t Klooster
Institution:Department of Analytical Chemistry, Delft University of Technology, Jaffalaan 9, DelftThe Netherlands;Department of Analytical Chemistry, State University of Utrecht, Croesestraat 77A, UtrechtThe Netherlands
Abstract:A procedure has been developed for estimating the information content of retrieval systems with binary-coded mass spectra, as well as mass spectra coded by other methods, from the statistical properties of a reference file. For a reference file, binary-coded with a threshold of 1% of the intensity of the base peak, this results typically in an estimated information content of about 50 bits for 200 selected mz values. It is shown that, because of errors occurring in the binary-coded spectra, the actual information content is only about 12 bits. This explains the poor performance observed for retrieval systems with binary-coded mass spectra.
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