Fraunhofer-Gesellschaft

Publica

Hier finden Sie wissenschaftliche Publikationen aus den Fraunhofer-Instituten.
2018The application of new HARD-descriptor available from the CORAL software to building up NOAEL models
Toropova, Alla P.; Toropov, Andrey A.; Marzo, Marco; Escher, Sylvia E.; Dorne, Jean Lou; Georgiadis, Nikolaos; Benfenati, Emilio
Journal Article
2016Innovative strategies to develop chemical categories using a combination of structural and toxicological properties
Batke, Monika; Gütlein, Martin; Partosch, Falko; Gundert-Remy, Ursula; Helma, Christoph; Kramer, Stefan; Maunz, Andreas; Seeland, Madeleine; Bitsch, Annette
Journal Article
2016Screening for potential endocrine disruptors in fish: Evidence from structural alerts and in vitro and in vivo toxicological assays
Nendza, Monika; Wenzel, Andrea; Müller, Martin; Lewin, Geertje; Simetska, Nelly; Stock, Frauke; Arning, Jürgen
Journal Article
2014Discriminating toxicant classes by mode of action. 4. Baseline and excess toxicity
Nendza, M.; Müller, M.; Wenzel, A.
Journal Article
2014A k-NN algorithm for predicting oral sub-chronic toxicity in the rat
Gadaleta, Domenico; Pizzo, Fabiola; Lombardo, Anna; Carotti, Angelo; Escher, Sylvia E.; Nicolotti, Orazio; Benfenati, Emilio
Journal Article
2013The OSIRIS weight of evidence approach: ITS mutagenicity and ITS carcinogenicity
Buist, Harrie; Aldenberg, Tom; Batke, Monika; Escher, Sylvia; Klein, Entink R.; Kühne, Ralph; Marquart, Hans; Pauné, Eduard; Rorije, Emiel; Schüürmann, Gerrit; Kroese, Dinant
Journal Article
2011Respiratory sensitization: Advances in assessing the risk of respiratory inflammation and irritation
Vandebriel, Rob; Cransveld, Conchita Callant; Crommelin, Daan; Diamant, Zuzana; Glazenburg, Berend; Joos, Guy; Kuper, Frieke; Natsch, Andreas; Nijkamp, Frans; Noteborn, Hub; Pieters, Raymond; Roberts, David; Roggen, Erwin; Rorije, Emiel; Seed, Martin; Sewald, Katharina; Heuvel, Rosette van den; Engelen, Jacqueline van; Verstraelen, Sandra; Loveren, Henk van
Journal Article
2010Screening for low aquatic bioaccumulation (1): Lipinski's 'Rule of 5' and molecular size
Nendza, M.; Müller, M.
Journal Article
2009Environmental properties of long-chain alcohols. Pt.2: Structure-activity relationship for chronic aquatic toxicity of long-chain alcohols
Schäfers, C.; Boshof, U.; Jürling, H.; Belanger, S.E.; Sanderson, H.; Dyer, S.D.; Nielsen, A.M.; Willing, A.; Gamon, K.; Kasai, Y.; Eadsforth, C.V.; Fisk, P.R.; Girling, A.E.
Journal Article
2004Entwicklung von QSAR-Modellen zur Beschreibung der Toxizität aliphatischer Amine gegenüber Embryos des Zebrabärblings Danio rerio
Müller, M.; Radke, K.; Nagel, R.
Presentation
2004PropertEst - a software system of environmental QSARs for chemical assessment
Wiandt, S.; Müller, M.
Poster
2002Quantitative structure-transformation relationships of sulfonylurea herbicides
Berger, B.M.; Müller, M.; Eing, A.
Journal Article
2001Discriminating Toxicant Classes by Mode of Action: 2. Physico-Chemical Descriptors
Nendza, M.; Müller, M.
Journal Article
2001QSAR of aliphatic amines using the embryotest with the zebrafish Danio rerio
Brust, K.; Müller, M.; Nagel, R.
Poster
2001Quantitative structure-transformation relationships of phenylurea herbicides
Berger, B.M.; Müller, M.; Eing, A.
Journal Article
1999Evaluation and application of models for the prediction of ready biodegradability in the MITI-I test
Rorije, E.; Loonen, H.; Müller, M.; Klopman, G.; Peijinenburg, W.J.G.M.
Journal Article
1999Short communication: A note of caution to users of ECOSAR
Kaiser, K.L.; Dearden, J.C.; Klein, W.; Schultz, T.W.
Journal Article
1997Commentary on the application of (Q)SAR to the toxicological evaluation of existing chemicals
Pölloth, C.; Mangelsdorf, I.
Journal Article
1997Multivariate modeling of soil sorption coefficients
Müller, M.
Conference Paper
1997Prediction of environmental degradation rates for high production volume chemicals (HPVC) using quantitative structure-activity relationships
Rorije, E.; Müller, M.; Peijnenburg, W.
Report
1997Quantum chemical modelling of soil sorption coefficients
Müller, M.
Journal Article
1996Comparison of screening methods for the estimation of adsorption coefficients on soil
Müller, Martin; Kördel, Werner
Conference Paper, Journal Article
1994Reactive substructures in the prediction of aquatic toxicity data
Jäckel, H.; Nendza, M.
Journal Article
1994SAR-system - estimating environmental relevant chemical properties from structure
Müller, M.
Conference Paper
1994Umweltchemische Aspekte und Ökotoxikologie. Struktur-Wirkungsbeziehungen
Müller, M.
Conference Paper
1993Abschätzung des umweltchemischen und ökotoxikologischen Verhaltens von Stoffen durch computergestützte Analyse von Struktur und Verhalten sowie von Struktur und Wirkung
Jäckel, H.; Müller, M.; Nendza, M.; Klein, W.; Gies-Reuschel, A.
Journal Article
1993Estimation of exposure and ecotoxicity related parameters by computer based structure-property and structure-activity relationships
Nendza, M.; Jäckel, H.; Müller, M.; Gies-Reuschel, A.; Klein, W.
Journal Article
1993Fugacity calculations using estimated physicochemical properties
Müller, M.; Klein, W.
Journal Article
1993Statistical approach to chemicals classification
Nendza, M.; Wenzel, A.
Journal Article
1992Comparative evaluation of methods predicting water solubility for organic compounds
Müller, M.; Klein, W.
Journal Article
1991Estimating atmospheric degradation processes by SARs
Müller, M.; Klein, W.
Journal Article
1991Prediction of mammalian toxicity by quantitative structure-activity relationships - aliphatic amines and anilines
Jäckel, H.; Klein, W.
Journal Article
1991Predictive QSAR models estimating ecotoxic hazard of phenylureas - aquatic toxicity
Nendza, M.
Journal Article
1991Predictive QSAR models estimating ecotoxic hazard of plant-protecting agents - target and non-target toxicity
Dittrich, B.; Wenzel, A.; Klein, W.; Nendza, M.
Journal Article
1991Predictive QSAR models for estimating biodegradation of aromatic compounds
Degner, P.; Klein, W.; Nendza, M.
Journal Article
1991QSAR modelling of the ERL-D fathead minnow acute toxicity database.
Russom, C.L.; Nendza, M.
Journal Article
1991QSARs of bioconcentration - validity assessment of log Pow / log BCF correlations
Nendza, M.
Book Article
1988Structure-activity relationships for selecting and setting priorities for existing chemicals - a computer-assisted approach.
Klein, A.W.; Klein, W.; Kördel, W.; Weiß, M.
Conference Paper