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A strategy for structuring and reporting a read-across prediction of toxicity

Regulatory toxicology and pharmacology, 2015-08, Vol.72 (3), p.586-601

2015

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Scientific issues that need to be addressed for a successful read-across prediction

Toxicology letters, 2018-10, Vol.295, p.S9-S10

Cronin, M.T.D.

2018

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An evaluation of global QSAR models for the prediction of the toxicity of phenols to Tetrahymena pyriformis

Chemosphere (Oxford), 2008-04, Vol.71 (7), p.1225-1232

2008

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Examination of Michael addition reactivity towards glutathione by transition-state calculations

SAR and QSAR in environmental research, 2010-10, Vol.21 (7-8), p.693-710

2010

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Definition of the structural domain of the baseline non-polar narcosis model for Tetrahymena pyriformis

SAR and QSAR in environmental research, 2008-10, Vol.19 (7-8), p.751-783

2008

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Identifying potential analogues for read-across in Physiologically-Based Kinetic (PBK) modelling

Toxicology letters, 2018-10, Vol.295, p.S100-S100

2018

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Development of KNIME workflow allowing identification of binders at the ecdysone receptor

Environmental toxicology and chemistry, 2020-06, Vol.39 (7), p.1438-1450

2020

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Investigation of the mechanism of flux across human skin in vitro by quantitative structure–permeability relationships

European journal of pharmaceutical sciences, 1999-03, Vol.7 (4), p.325-330

1999

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Sub-structure-based category formation for the prioritisation of genotoxicity hazard assessment for pesticide residues (part 2): Triazoles

Regulatory toxicology and pharmacology, 2022-10, Vol.134, p.105237-105237, Article 105237

2022

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Molecular fingerprint-derived similarity measures for toxicological read-across: Recommendations for optimal use

Regulatory toxicology and pharmacology, 2019-02, Vol.101, p.121-134

2019

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How not to develop a quantitative structure-activity or structure-property relationship (QSAR/QSPR)

SAR and QSAR in environmental research, 2009-01, Vol.20 (3-4), p.241-266

2009

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Metabolism-based category formation for the prioritisation of genotoxicity hazard assessment for plant protection product residues (Part 4): α-Chloroacetamides

Regulatory toxicology and pharmacology, 2024-06, Vol.150, p.105641-105641, Article 105641

2024

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Metabolism-based category formation for the prioritisation of genotoxicity hazard assessment for plant protection product residues (part 3): Strobilurins

Regulatory toxicology and pharmacology, 2023-10, Vol.144, p.105484-105484, Article 105484

2023

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Sub-structure-based category formation for the prioritisation of genotoxicity hazard assessment for pesticide residues: Sulphonyl ureas

Regulatory toxicology and pharmacology, 2022-03, Vol.129, p.105115-105115, Article 105115

2022

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Development of a Robust In Silico Profiler to Screen for Nephrotoxicity Endpoints

Toxicology letters, 2018-10, Vol.295, p.S97-S97

2018

Volltextzugriff (PDF)

A European perspective on alternatives to animal testing for environmental hazard identification and risk assessment

Regulatory toxicology and pharmacology, 2013-12, Vol.67 (3), p.506-530

2013

Volltextzugriff (PDF)

An extended mechanistically-based in silico profiler for liver toxicity

Toxicology letters, 2018-10, Vol.295, p.S101-S101

2018

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Characterisation of data resources for in silico modelling: benchmark datasets for ADME properties

Expert opinion on drug metabolism & toxicology, 2018-02, Vol.14 (2), p.169-181

2018

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Development of new structural alerts suitable for chemical category formation for assigning covalent and non-covalent mechanisms relevant to DNA binding

Mutation research, 2012-03, Vol.743 (1-2), p.10-19

2012

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The importance of hydrophobicity and electrophilicity descriptors in mechanistically-based QSARs for toxicological endpoints

SAR and QSAR in environmental research, 2002, Vol.13 (1), p.167-176

2002

Volltextzugriff (PDF)

Screening Chemicals for Receptor-Mediated Toxicological and Pharmacological Endpoints: Using Public Data to Build Screening Tools within a KNIME Workflow

Molecular informatics, 2015-02, Vol.34 (2-3), p.171-178

2015

Volltextzugriff (PDF)

Cosmetic Europe's long range science strategy – A non-animal safety assessment case study for phenoxyethanol, a cosmetic ingredient

Toxicology letters, 2018-10, Vol.295, p.S171-S171

2018

Volltextzugriff (PDF)

ToxGPS, a solution guiding read-across workflow based on chemoinformatics and safety assessment

Toxicology letters, 2018-10, Vol.295, p.S104-S105

2018

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Perspectives for integrating human and environmental risk assessment and synergies with socio-economic analysis

The Science of the total environment, 2013-07, Vol.456-457, p.307-316

2013

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Application of threshold of toxicological concern to biocides

Toxicology letters, 2015-10, Vol.238 (2), p.S361-S361

2015

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A strategy for structuring and reporting a read-across prediction of toxicity

Scientific issues that need to be addressed for a successful read-across prediction

An evaluation of global QSAR models for the prediction of the toxicity of phenols to Tetrahymena pyriformis

Examination of Michael addition reactivity towards glutathione by transition-state calculations

Definition of the structural domain of the baseline non-polar narcosis model for Tetrahymena pyriformis

Identifying potential analogues for read-across in Physiologically-Based Kinetic (PBK) modelling

Development of KNIME workflow allowing identification of binders at the ecdysone receptor

Investigation of the mechanism of flux across human skin in vitro by quantitative structure–permeability relationships

Sub-structure-based category formation for the prioritisation of genotoxicity hazard assessment for pesticide residues (part 2): Triazoles

Molecular fingerprint-derived similarity measures for toxicological read-across: Recommendations for optimal use

How not to develop a quantitative structure-activity or structure-property relationship (QSAR/QSPR)

Metabolism-based category formation for the prioritisation of genotoxicity hazard assessment for plant protection product residues (Part 4): α-Chloroacetamides

Metabolism-based category formation for the prioritisation of genotoxicity hazard assessment for plant protection product residues (part 3): Strobilurins

Sub-structure-based category formation for the prioritisation of genotoxicity hazard assessment for pesticide residues: Sulphonyl ureas

Development of a Robust In Silico Profiler to Screen for Nephrotoxicity Endpoints

A European perspective on alternatives to animal testing for environmental hazard identification and risk assessment

An extended mechanistically-based in silico profiler for liver toxicity

Characterisation of data resources for in silico modelling: benchmark datasets for ADME properties

Development of new structural alerts suitable for chemical category formation for assigning covalent and non-covalent mechanisms relevant to DNA binding

The importance of hydrophobicity and electrophilicity descriptors in mechanistically-based QSARs for toxicological endpoints

Screening Chemicals for Receptor-Mediated Toxicological and Pharmacological Endpoints: Using Public Data to Build Screening Tools within a KNIME Workflow

Cosmetic Europe's long range science strategy – A non-animal safety assessment case study for phenoxyethanol, a cosmetic ingredient

ToxGPS, a solution guiding read-across workflow based on chemoinformatics and safety assessment

Perspectives for integrating human and environmental risk assessment and synergies with socio-economic analysis

Application of threshold of toxicological concern to biocides

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