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Modelling and Prediction of Toxicity of Environmental Pollutants
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BibTeX
@MISC{Lemke_modellingand,
author = {Frank Lemke and Johann-adolf Müller and Emilio Benfenati},
title = {Modelling and Prediction of Toxicity of Environmental Pollutants},
year = {}
}
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Abstract
Abstract. This paper describes the problem of modelling toxicity of environmental pollutants using molecular descriptors from a systems theoretical viewpoint. It is shown that current toxicity modelling problems systematically incorporate very high levels of noise a priori. By means of a set of individual and combined models self-organised by KnowledgeMiner from a high-dimensional molecular descriptor data set calculated within the DEMETRA project we suggest a way how results interpretation and final decision making can effectively take into account the huge uncertainty of toxicity models.
