  | | Potential use | Responsible scientists | Related to deliverable |
|---|
 | "MIRA" | Tool for making an overall prediction of degradation of chemicals from several different models. | | D.2.4.6 |
| CATALOGIC-Soil BioPath | An extension of biodegradation CATALOGIC models enabling predicting biodegradation pathways in soil. | Prof. Ovanes Mekenyan, Ph. D., D. Sci. Department of Physical Chemistry Laboratory of Mathematical Chemistry, Head Bourgas "Prof. As. Zlatarov" University "Yakimov" St. #1 8010 Bourgas Bulgaria phone: ++359 56 880230 (also personal fax) ++359 56 858343 fax: ++359 56 880249 LMC website: http://www.oasis-lmc.org/ | D.2.3.12 |
| Elimination Kinetics Model for Earthworms | The model estimates the elimination kinetics of organic chemicals in earthworms explicitly accounting for their metabolic potential. | Prof. Ovanes Mekenyan, Ph. D., D. Sci. Department of Physical Chemistry Laboratory of Mathematical Chemistry, Head Bourgas "Prof. As. Zlatarov" University "Yakimov" St. #1 8010 Bourgas Bulgaria phone: ++359 56 880230 (also personal fax) ++359 56 858343 fax: ++359 56 880249 LMC website: http://www.oasis-lmc.org/ | D.2.3.12 and D.3.3.4A |
| “MAPPE” (Multimedia Assessment of Pollutant Pathways in Europe) | An ArcGIS extension enabling production of maps of chemical distribution in air, soil and water at the European continental scale. | | D.2.4.6 |
| Nested box model | Estimates spatially variable concentrations in Europe. | | D 2.4.7, D 2.4.14 |
| Diffusive sampling techniques | Diffusive sampling techniques directed at “available exposure” | | WP 2.2 |
| Water-Sediment Screening Tool (WSST) | Screening tool to determine biodegradation rates and kinetics of organic chemicals in water-sediment systems. | Thomas Junker, ECT Oekotoxikologie GmbH, D-65439 Flörsheim, Germany, th-junker@ect.de | D.2.3.1, D.2.3.2, D.2.3.7, D.2.3.14, D.2.3.17 |
| Fragment Model to Prediction the Hydrogen Bond Acceptor Strength | Fragment Model to Prediction the Hydrogen Bond Acceptor Strength | | D.2.1.4, D2.1.18 |
| Fragment Model to Prediction the Hydrogen Bond Donor Strength | Fragment Model to Prediction the Hydrogen Bond Donor Strength | | D.2.1.4, D.2.1.6, D2.1.18 |
| Quantum-Chemical Model to Predict the Hydrogen Bond Donor Strength | Quantum-Chemical Model to Predict the Hydrogen Bond Donor Strength
| | D.2.1.5, D.2.1.6, D.2.1.11 |
| Semi-Empirical Quantum-Chemical Model to Predict the Hydrogen Bond Acceptor Strength | Semi-Empirical Quantum-Chemical Model to Predict the Hydrogen Bond Acceptor Strength | | D.2.1.5, D.2.1.11 |
| Validated Experimental Procedure for the Determination of the Membrane/Water Partition Coefficient | Validated Experimental Procedure for the Determination of the Membrane/Water Partition Coefficient
| | D.2.1.3 |
| LSER (Abraham Type) Equation to Predict the Membrane/Water Partition Coefficient | LSER (Abraham Type) Equation to Predict the Membrane/Water Partition Coefficient
| | D.2.1.13 |
| Ab initio Quantum-Chemical Model for Indirect Photolysis OH Rate Predictions | Ab initio Quantum-Chemical Model for Indirect Photolysis OH Rate Predictions | | D.2.3.8, D.2.3.11 |
| Semi-Empirical Quantum-Chemical Model for Indirect Photolysis OH Rate Predictions | Semi-Empirical Quantum-Chemical Model for Indirect Photolysis OH Rate Predictions | | D.2.3.8, D.2.3.11 |
| Ab initio Quantum-Chemical Model to Predict the Hydrogen Bond Acceptor Strength | Ab initio Quantum-Chemical Model to Predict the Hydrogen Bond Acceptor Strength
| | D.2.1.5, D.2.1.11 |