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Evaluation of human pharmaceutical emissions and concentrations in Swedish river basins

The Science of the total environment, 2016-12, Vol.572, p.508-519

2016

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QSAR Toolbox - workflow and major functionalities

SAR and QSAR in environmental research, 2016-03, Vol.27 (3), p.203-219

2016

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Model-predicted occurrence of multiple pharmaceuticals in Swedish surface waters and their flushing to the Baltic Sea

Environmental pollution (1987), 2017-04, Vol.223, p.595-604

2017

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Hazard Evaluation Support System (HESS) for predicting repeated dose toxicity using toxicological categories

SAR and QSAR in environmental research, 2013-05, Vol.24 (5), p.351-363

2013

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Accounting for data variability, a key factor in in vivo/in vitro relationships: application to the skin sensitization potency (in vivo LLNA versus in vitro DPRA) example

Journal of applied toxicology, 2016-12, Vol.36 (12), p.1568-1578

2016

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Simulation of chemical metabolism for fate and hazard assessment. II CATALOGIC simulation of abiotic and microbial degradation

SAR and QSAR in environmental research, 2011-10, Vol.22 (7-8), p.719-755

2011

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Identification of the Structural Requirements for Mutagencitiy, by Incorporating Molecular Flexibility and Metabolic Activation of Chemicals. II. General Ames Mutagenicity Model

Chemical research in toxicology, 2007-04, Vol.20 (4), p.662-676

2007

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Simulation of chemical metabolism for fate and hazard assessment. I. Approach for simulating metabolism

SAR and QSAR in environmental research, 2011-10, Vol.22 (7-8), p.699-718

2011

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Simulation of chemical metabolism for fate and hazard assessment. V. Mammalian hazard assessment

SAR and QSAR in environmental research, 2012-07, Vol.23 (5-6), p.553-606

2012

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Development of a biodegradation model for the prediction of metabolites in soil

The Science of the total environment, 2010-08, Vol.408 (18), p.3811-3816

2010

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TIMES-SS - Recent refinements resulting from an industrial skin sensitisation consortium

SAR and QSAR in environmental research, 2014-01, Vol.25 (5), p.367-391

2014

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CATALOGIC 301C model - validation and improvement

SAR and QSAR in environmental research, 2017-06, Vol.28 (6), p.511-524

2017

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Predicting bioconcentration factors of highly hydrophobic chemicals. Effects of molecular size

Pure and applied chemistry, 2002-10, Vol.74 (10), p.1823-1830

2002

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Base-line model for identifying the bioaccumulation potential of chemicals

SAR and QSAR in environmental research, 2005-12, Vol.16 (6), p.531-554

2005

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The use of metabolising systems for in vitro testing of endocrine disruptors

Current drug metabolism, 2008-10, Vol.9 (8), p.796-826

2008

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Simulation of chemical metabolism for fate and hazard assessment. III. New developments of the bioconcentration factor base-line model

SAR and QSAR in environmental research, 2012-01, Vol.23 (1-2), p.17-36

2012

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A systematic approach to simulating metabolism in computational toxicology. I. The TIMES heuristic modelling framework

Current pharmaceutical design, 2004-04, Vol.10 (11), p.1273-1293

2004

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Simulation of chemical metabolism for fate and hazard assessment. IV. Computer-based derivation of metabolic simulators from documented metabolism maps

SAR and QSAR in environmental research, 2012-07, Vol.23 (5-6), p.371-387

2012

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Androgen receptor binding affinity: a QSAR evaluation

SAR and QSAR in environmental research, 2011-06, Vol.22 (3-4), p.265-291

2011

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Probabilistic assessment of biodegradability based on metabolic pathways: CATABOL System

SAR and QSAR in environmental research, 2002-01, Vol.13 (2), p.307-323

2002

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Elimination kinetic model for organic chemicals in earthworms

The Science of the total environment, 2010-08, Vol.408 (18), p.3787-3793

2010

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Steric effects in drug design

1983

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Mechanism-based categorization of aromatase inhibitors: a potential discovery and screening tool

SAR and QSAR in environmental research, 2009-10, Vol.20 (7-8), p.657-678

2009

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QSAR and mechanistic interpretation of estrogen receptor binding

SAR and QSAR in environmental research, 2007-05, Vol.18 (3-4), p.389-421

2007

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Mechanism-based common reactivity pattern (COREPA) modelling of aryl hydrocarbon receptor binding affinity

SAR and QSAR in environmental research, 2010-01, Vol.21 (1-2), p.187-214

2010

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Evaluation of human pharmaceutical emissions and concentrations in Swedish river basins

QSAR Toolbox - workflow and major functionalities

Model-predicted occurrence of multiple pharmaceuticals in Swedish surface waters and their flushing to the Baltic Sea

Hazard Evaluation Support System (HESS) for predicting repeated dose toxicity using toxicological categories

Accounting for data variability, a key factor in in vivo/in vitro relationships: application to the skin sensitization potency (in vivo LLNA versus in vitro DPRA) example

Simulation of chemical metabolism for fate and hazard assessment. II CATALOGIC simulation of abiotic and microbial degradation

Identification of the Structural Requirements for Mutagencitiy, by Incorporating Molecular Flexibility and Metabolic Activation of Chemicals. II. General Ames Mutagenicity Model

Simulation of chemical metabolism for fate and hazard assessment. I. Approach for simulating metabolism

Simulation of chemical metabolism for fate and hazard assessment. V. Mammalian hazard assessment

Development of a biodegradation model for the prediction of metabolites in soil

TIMES-SS - Recent refinements resulting from an industrial skin sensitisation consortium

CATALOGIC 301C model - validation and improvement

Predicting bioconcentration factors of highly hydrophobic chemicals. Effects of molecular size

Base-line model for identifying the bioaccumulation potential of chemicals

The use of metabolising systems for in vitro testing of endocrine disruptors

Simulation of chemical metabolism for fate and hazard assessment. III. New developments of the bioconcentration factor base-line model

A systematic approach to simulating metabolism in computational toxicology. I. The TIMES heuristic modelling framework

Simulation of chemical metabolism for fate and hazard assessment. IV. Computer-based derivation of metabolic simulators from documented metabolism maps

Androgen receptor binding affinity: a QSAR evaluation

Probabilistic assessment of biodegradability based on metabolic pathways: CATABOL System

Elimination kinetic model for organic chemicals in earthworms

Steric effects in drug design

Mechanism-based categorization of aromatase inhibitors: a potential discovery and screening tool

QSAR and mechanistic interpretation of estrogen receptor binding

Mechanism-based common reactivity pattern (COREPA) modelling of aryl hydrocarbon receptor binding affinity

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