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Quantitative structure − skin permeability relationships

Toxicology (Amsterdam), 2017-07, Vol.387, p.27-42

2017

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Use of In Silico Methods for Regulatory Toxicological Assessment of Pharmaceutical Impurities

Methods in molecular biology (Clifton, N.J.), 2022, Vol.2425, p.537

2022

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QSAR Modeling is not "Push a Button and Find a Correlation": A Case Study of Toxicity of (Benzo-)triazoles on Algae

Molecular informatics, 2012-12, Vol.31 (11-12), p.817-835

2012

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Daphnia and fish toxicity of (benzo)triazoles: Validated QSAR models, and interspecies quantitative activity–activity modelling

Journal of hazardous materials, 2013-08, Vol.258-259, p.50-60

2013

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QSAR classification models for the prediction of endocrine disrupting activity of brominated flame retardants

Journal of hazardous materials, 2011-06, Vol.190 (1), p.106-112

2011

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QSAR Modeling and Prediction of the Endocrine-Disrupting Potencies of Brominated Flame Retardants

Chemical research in toxicology, 2010-05, Vol.23 (5), p.946-954

2010

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Modeling ready biodegradability of fragrance materials

Environmental toxicology and chemistry, 2015-06, Vol.34 (6), p.1224-1231

2015

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Filling Data Gaps by Read‐across: A Mini Review on its Application, Developments and Challenges

Molecular informatics, 2019-08, Vol.38 (8-9), p.e1800121-n/a

2019

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Internationalization of read-across as a validated new approach method (NAM) for regulatory toxicology

ALTEX, alternatives to animal experimentation, 2020-01, Vol.37 (4), p.579-606

2020

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Evaluating the mutagenic potential of aerosol organic compounds using informatics-based screening

Atmospheric chemistry and physics, 2018-02, Vol.18 (3), p.2329-2340

2018

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High-Throughput Analysis of Ovarian Cycle Disruption by Mixtures of Aromatase Inhibitors

Environmental health perspectives, 2017-07, Vol.125 (7), p.077012-077012

2017

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Multiscale modelling approaches for assessing cosmetic ingredients safety

Toxicology (Amsterdam), 2017-12, Vol.392, p.130-139

2017

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Development of an ECHA structured database on repeated dose toxicity

Toxicology letters, 2017-10, Vol.280, p.S302-S302

2017

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The Consultancy Activity on In Silico Models for Genotoxic Prediction of Pharmaceutical Impurities

Methods in molecular biology (Clifton, N.J.), 2016, Vol.1425, p.511

2016

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The application of molecular modelling in the safety assessment of chemicals: A case study on ligand-dependent PPARγ dysregulation

Toxicology (Amsterdam), 2017-12, Vol.392, p.140-154

2017

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On the Use of Local and Global QSPRs for the Prediction of Physico-chemical Properties of Polybrominated Diphenyl Ethers

Molecular informatics, 2011-03, Vol.30 (2-3), p.232-240

2011

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Toward establishing a standardized process and tool within the read-across workflow: A case study of agrochemicals for reproductive toxicity

Toxicology letters, 2017-10, Vol.280, p.S285-S286

2017

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Experimental Assessment of the Environmental Fate and Effects of Triazoles and Benzotriazole

Alternatives to laboratory animals, 2013-03, Vol.41 (1), p.65-75

2013

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Ranking strategies to support toxicity prediction: A case study on potential LXR binders

Computational toxicology, 2019-05, Vol.10, p.130-144

2019

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Daphnia and fish toxicity of (benzo)triazoles: Validated QSAR models, and interspecies quantitative activity-activity modelling

Journal of hazardous materials, 2013, Vol.258-59, p.50-60

2013

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UNDERSTANDING QUANTITATIVE STRUCTURE-PROPERTY RELATIONSHIPS UNCERTAINTY IN ENVIRONMENTAL FATE MODELING

Environmental toxicology and chemistry, 2013-05, Vol.32 (5), p.1069-1076

2013

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Assessing predictive uncertainty in comparative toxicity potentials of triazoles

Environmental toxicology and chemistry, 2014-02, Vol.33 (2), p.293-301

2014

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CADASTER QSPR Models for Predictions of Melting and Boiling Points of Perfluorinated Chemicals

Molecular informatics, 2011-03, Vol.30 (2-3), p.189-204

2011

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Evaluation of CADASTER QSAR Models for the Aquatic Toxicity of (Benzo)triazoles and Prioritisation by Consensus Prediction

Alternatives to laboratory animals, 2013-03, Vol.41 (1), p.49-64

2013

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The QSPR-THESAURUS: The Online Platform of the CADASTER Project

Alternatives to laboratory animals, 2014-03, Vol.42 (1), p.13-24

2014

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Quantitative structure − skin permeability relationships

Use of In Silico Methods for Regulatory Toxicological Assessment of Pharmaceutical Impurities

QSAR Modeling is not "Push a Button and Find a Correlation": A Case Study of Toxicity of (Benzo-)triazoles on Algae

Daphnia and fish toxicity of (benzo)triazoles: Validated QSAR models, and interspecies quantitative activity–activity modelling

QSAR classification models for the prediction of endocrine disrupting activity of brominated flame retardants

QSAR Modeling and Prediction of the Endocrine-Disrupting Potencies of Brominated Flame Retardants

Modeling ready biodegradability of fragrance materials

Filling Data Gaps by Read‐across: A Mini Review on its Application, Developments and Challenges

Internationalization of read-across as a validated new approach method (NAM) for regulatory toxicology

Evaluating the mutagenic potential of aerosol organic compounds using informatics-based screening

High-Throughput Analysis of Ovarian Cycle Disruption by Mixtures of Aromatase Inhibitors

Multiscale modelling approaches for assessing cosmetic ingredients safety

Development of an ECHA structured database on repeated dose toxicity

The Consultancy Activity on In Silico Models for Genotoxic Prediction of Pharmaceutical Impurities

The application of molecular modelling in the safety assessment of chemicals: A case study on ligand-dependent PPARγ dysregulation

On the Use of Local and Global QSPRs for the Prediction of Physico-chemical Properties of Polybrominated Diphenyl Ethers

Toward establishing a standardized process and tool within the read-across workflow: A case study of agrochemicals for reproductive toxicity

Experimental Assessment of the Environmental Fate and Effects of Triazoles and Benzotriazole

Ranking strategies to support toxicity prediction: A case study on potential LXR binders

Daphnia and fish toxicity of (benzo)triazoles: Validated QSAR models, and interspecies quantitative activity-activity modelling

UNDERSTANDING QUANTITATIVE STRUCTURE-PROPERTY RELATIONSHIPS UNCERTAINTY IN ENVIRONMENTAL FATE MODELING

Assessing predictive uncertainty in comparative toxicity potentials of triazoles

CADASTER QSPR Models for Predictions of Melting and Boiling Points of Perfluorinated Chemicals

Evaluation of CADASTER QSAR Models for the Aquatic Toxicity of (Benzo)triazoles and Prioritisation by Consensus Prediction

The QSPR-THESAURUS: The Online Platform of the CADASTER Project

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