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Stefan Pudenz

Publications and source records attributed to Stefan Pudenz.

6 recordsLinked to original sources

Chemical databases evaluated by order theoretical tools.

Data on environmental chemicals are urgently needed to comply with the future chemicals policy in the European Union. The availability of data on parameters and chemicals can be evaluated by chemometrical and environmetrical methods. Different mathematical and statistical methods are taken into account in this paper. The emphasis is set on a new, discrete mathematical method called METEOR (method of evaluation by order theory). Application of the Hasse diagram technique (HDT) of the complete data-matrix comprising 12 objects (databases) x 27 attributes (parameters + chemicals) reveals that ECOTOX (ECO), environmental fate database (EFD) and extoxnet (EXT)--also called multi-database databases--are best. Most single databases which are specialised are found in a minimal position in the Hasse diagram; these are biocatalysis/biodegradation database (BID), pesticide database (PES) and UmweltInfo (UMW). The aggregation of environmental parameters and chemicals (equal weight) leads to a slimmer data-matrix on the attribute side. However, no significant differences are found in the "best" and "worst" objects. The whole approach indicates a rather bad situation in terms of the availability of data on existing chemicals and hence an alarming signal concerning the new and existing chemicals policies of the EEC.

Biodegradation, Environmental↗

Aspects of decision support in water management--example Berlin and Potsdam (Germany) I--spatially differentiated evaluation.

Decisions about sustainable development demand spatially differentiated evaluations. As an example, we demonstrate the evaluation of water management strategies in the cities of Berlin and Potsdam (Germany) with respect to their ecological effects in 14 sections of the surface water system. Two decision support systems were compared, namely PROMETHEE, which is designed to obtain a clear decision (linear ranking), and Hasse Diagram Technique (HDT), normally providing more than one favourable solution (partial order). By PROMETHEE, the spatial differentiation had unwanted effects on the result, negating the stakeholders determined weighting of indicators. Therefore, the stakeholder can barely benefit from the convenience of obtaining a clear decision (linear ranking). In contrast, the result obtained by HDT was not influenced by spatial differentiation. Furthermore, HDT provided helpful tools to analyse the evaluation result, such as the concept of antagonistic indicators to discover conflicts in the evaluation process.

Cities↗

Aspects of decision support in water management--example Berlin and Potsdam (Germany) II--improvement of management strategies.

Methods related to partial order theory such as the Hasse diagram technique (HDT) are increasingly used in the field of multi-criteria decision support. The HDT has the advantage of being a transparent evaluation tool, supported by several data analysis tools such as the concept of antagonistic indicators. However, the evaluation usually does not lead to a clear decision, because more than one possible solution is offered. In the example presented here, three of the nine water management strategies (scenarios) evaluated by HDT were identified as winners. However, these strategies were not comparable with each other because of the conflicting evaluation of at least two different indicators. Such antagonisms describe the advantage and disadvantage of each scenario. Based on this background information, a new innovative approach is demonstrated, enabling the stakeholders to design new, modified management strategies, with reduced negative effects. After improvement of the three potential solutions, one clear winner scenario could be identified.

Decision Support Techniques↗

Analysis of monitoring data of pesticide residues in surface waters using partial order ranking theory.

In this investigation, a new and simple way to analyze, interpret, and generalize monitoring data of occurrence of pesticide active ingredients in surface waters was developed. The occurrence is quantified using the variables frequency of detection and the concentration level. These two parameters are associated with basically different ecotoxicological effects; for example, a high frequency of detection may be related to bioaccumulation problems, while the level of concentration also controls the acute toxicological effects. The active ingredients were ranked on the basis of the monitoring data in relation to both the frequency of finding and concentration level using the concept of partial ordered sets. The resulting rankings was correlated with other rankings based on descriptors such as sprayed area, applied dose, adsorption to soil organic carbon, vapor pressure, and soil dissipation half-life. A similarity index was applied in order to compare the ranking of the monitoring data with the ranking of the descriptors. It is shown how partial order theory can be used to evaluate the relevance of every single descriptor. The dosage is found to be the most important descriptor, followed by the sprayed area and the adsorption to organic carbon ending up a very close similarity between, respectively, the rankings using monitoring data and rankings using these three descriptors.

Data Interpretation, Statistical↗

QSAR of ecotoxicological data on the basis of data-driven if-then-rules.

A rather small data matrix of seven chemicals and 17 different ecotoxicological end points is examined by methods of Discrete Mathematics. Especially, the lattice theory and its variant, the Formal Concept Analysis may be an attractive tool to analyze Quantitative Structure Activity Relationships, when a numerical functional approach is not at hand. The central item is the so called concept, which is a pair of subsets: A subset of molecules and a subset of properties which correspond to each other. The concepts are partially ordered due to a subset relation. From this subset relation, if-then-rules are derived, which aim to relate the structure of molecules with their ecotoxicological properties. For example, the following chemical rule is found: Cl --> (2A,2C,2M). That means, all substances considered here having a "-Cl" as structural code have a medium ecotoxicological effect on Daphnia magna, Orconectes immunisare (Crustacea) and on Photobacterium phosphoreum, at least within the training set.

Animals↗

Application of a sediment quality triad and different statistical approaches (Hasse diagrams and fuzzy logic) for the comparative evaluation of small streams.

In order to evaluate the ecotoxicological contamination of 12 aquatic sites in streams within the catchment area of the Neckar River, a sediment quality triad (SQT) approach was applied. In contrast to Chapman's original triad approach, not only sediments, but also surface waters were examined. In brief, to obtain a comprehensive insight into the potential ecotoxicological hazard, both acute toxicity and more specific effects such as mutagenic, genotoxic, teratogenic, dioxin- and estrogen-like responses were recorded. Different statistical methods (ranking, cluster analyses, Hasse diagram techniques, and fuzzy logic) for the evaluation and presentation of the SQT data were compared with respect to the needs of environmental decision-making. Results document advantages and disadvantages of the methods applied for the evaluation and classification of data within the complex data matrixes. The ranking procedure presented as well as the Hasse diagram technique seem to be suitable tools to elucidate the pattern of the ecotoxicological load. However, these classification methods require expert knowledge to interpret the ranking results with respect to decision-making in environmental sciences and policy. In contrast, fuzzy logic allows both to develop site-specific expert systems in order to assess the ecotoxicological burden and to give insight into the pattern of the contamination.

Animals↗