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Ecotoxicity interspecies QAAR models from Daphnia toxicity of pharmaceuticals and personal care products

SAR and QSAR in environmental research, 2016-10, Vol.27 (10), p.781-798

2016

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Modelling physico-chemical properties of (benzo)triazoles, and screening for environmental partitioning

Water research (Oxford), 2011-01, Vol.45 (3), p.1463-1471

2011

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Benzotriazoles, alkylphenols and bisphenol A in municipal wastewaters and in the Glatt River, Switzerland

Environmental science and pollution research international, 2006-09, Vol.13 (5), p.333-341

2006

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Joint algal toxicity of 16 dissimilarly acting chemicals is predictable by the concept of independent action

Aquatic toxicology, 2003-03, Vol.63 (1), p.43-63

2003

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Pharmaceutical ecotoxicity: Data curation and QSAR modeling

Toxicology letters, 2015-10, Vol.238 (2), p.S165-S165

2015

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Linear QSAR regression models for the prediction of bioconcentration factors by physicochemical properties and structural theoretical molecular descriptors

Chemosphere (Oxford), 2007-02, Vol.67 (2), p.351-358

2007

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QSAR classification of estrogen receptor binders and pre-screening of potential pleiotropic EDCs

SAR and QSAR in environmental research, 2010-10, Vol.21 (7-8), p.657-669

2010

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Modelling and prediction of soil sorption coefficients of non-ionic organic pesticides by molecular descriptors

Chemosphere (Oxford), 2000-09, Vol.41 (5), p.763-777

2000

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QSAR prediction of the competitive interaction of emerging halogenated pollutants with human transthyretin

SAR and QSAR in environmental research, 2013-04, Vol.24 (4), p.333-349

2013

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Predicting the joint algal toxicity of multi-component s-triazine mixtures at low-effect concentrations of individual toxicants

Aquatic toxicology, 2001-12, Vol.56 (1), p.13-32

2001

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A tool for the assessment of VOC degradability by tropospheric oxidants starting from chemical structure

Atmospheric environment (1994), 2004-11, Vol.38 (36), p.6167-6175

2004

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Prediction of PAH mutagenicity in human cells by QSAR classification

SAR and QSAR in environmental research, 2008-01, Vol.19 (1-2), p.115-127

2008

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Approaches for externally validated QSAR modelling of Nitrated Polycyclic Aromatic Hydrocarbon mutagenicity

SAR and QSAR in environmental research, 2007-01, Vol.18 (1-2), p.169-178

2007

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Externally validated QSPR modelling of VOC tropospheric oxidation by NO3 radicals

SAR and QSAR in environmental research, 2008-01, Vol.19 (7-8), p.655-668

2008

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Predicting the NO3 radical tropospheric degradability of organic pollutants by theoretical molecular descriptors

Atmospheric environment (1994), 2003-07, Vol.37 (22), p.3115-3124

2003

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Quantitative structure-activity relationship modelling of oral acute toxicity and cytotoxic activity of fragrance materials in rodents

SAR and QSAR in environmental research, 2009-10, Vol.20 (7-8), p.767-779

2009

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CoMPARA: Collaborative Modeling Project for Androgen Receptor Activity

Environmental health perspectives, 2020-02, Vol.128 (2), p.27002

2020

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QSAR approach to POPs screening for atmospheric persistence

Chemosphere (Oxford), 2001-05, Vol.43 (4), p.655-664

2001

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Methods for Reliability and Uncertainty Assessment and for Applicability Evaluations of Classification- and Regression-Based QSARs

Environmental health perspectives, 2003-08, Vol.111 (10), p.1361-1375

2003

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Triadimefon causes branchial arch malformations in Xenopus laevis embryos

Environmental science and pollution research international, 2006-07, Vol.13 (4), p.251-255

2006

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Validated QSAR Prediction of OH Tropospheric Degradation of VOCs: Splitting into Training−Test Sets and Consensus Modeling

Journal of Chemical Information and Computer Sciences, 2004-09, Vol.44 (5), p.1794-1802

2004

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3D-modelling and prediction by WHIM descriptors. Part 9. Chromatographic relative retention time and physico-chemical properties of polychlorinated biphenyls (PCBs)

Chemometrics and intelligent laboratory systems, 1998-05, Vol.40 (1), p.53-63

1998

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Water quality objectives for mixtures of toxic chemicals: problems and perspectives

Ecotoxicology and environmental safety, 2003-02, Vol.54 (2), p.139-150

2003

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Statistically Validated QSARs, Based on Theoretical Descriptors, for Modeling Aquatic Toxicity of Organic Chemicals in Pimephales promelas (Fathead Minnow)

Journal of chemical information and modeling, 2005-09, Vol.45 (5), p.1256-1266

2005

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QSAR Prediction of Estrogen Activity for a Large Set of Diverse Chemicals under the Guidance of OECD Principles

Chemical research in toxicology, 2006-11, Vol.19 (11), p.1540-1548

2006

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Ecotoxicity interspecies QAAR models from Daphnia toxicity of pharmaceuticals and personal care products

Modelling physico-chemical properties of (benzo)triazoles, and screening for environmental partitioning

Benzotriazoles, alkylphenols and bisphenol A in municipal wastewaters and in the Glatt River, Switzerland

Joint algal toxicity of 16 dissimilarly acting chemicals is predictable by the concept of independent action

Pharmaceutical ecotoxicity: Data curation and QSAR modeling

Linear QSAR regression models for the prediction of bioconcentration factors by physicochemical properties and structural theoretical molecular descriptors

QSAR classification of estrogen receptor binders and pre-screening of potential pleiotropic EDCs

Modelling and prediction of soil sorption coefficients of non-ionic organic pesticides by molecular descriptors

QSAR prediction of the competitive interaction of emerging halogenated pollutants with human transthyretin

Predicting the joint algal toxicity of multi-component s-triazine mixtures at low-effect concentrations of individual toxicants

A tool for the assessment of VOC degradability by tropospheric oxidants starting from chemical structure

Prediction of PAH mutagenicity in human cells by QSAR classification

Approaches for externally validated QSAR modelling of Nitrated Polycyclic Aromatic Hydrocarbon mutagenicity

Externally validated QSPR modelling of VOC tropospheric oxidation by NO3 radicals

Predicting the NO3 radical tropospheric degradability of organic pollutants by theoretical molecular descriptors

Quantitative structure-activity relationship modelling of oral acute toxicity and cytotoxic activity of fragrance materials in rodents

CoMPARA: Collaborative Modeling Project for Androgen Receptor Activity

QSAR approach to POPs screening for atmospheric persistence

Methods for Reliability and Uncertainty Assessment and for Applicability Evaluations of Classification- and Regression-Based QSARs

Triadimefon causes branchial arch malformations in Xenopus laevis embryos

Validated QSAR Prediction of OH Tropospheric Degradation of VOCs: Splitting into Training−Test Sets and Consensus Modeling

3D-modelling and prediction by WHIM descriptors. Part 9. Chromatographic relative retention time and physico-chemical properties of polychlorinated biphenyls (PCBs)

Water quality objectives for mixtures of toxic chemicals: problems and perspectives

Statistically Validated QSARs, Based on Theoretical Descriptors, for Modeling Aquatic Toxicity of Organic Chemicals in Pimephales promelas (Fathead Minnow)

QSAR Prediction of Estrogen Activity for a Large Set of Diverse Chemicals under the Guidance of OECD Principles

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