All Stories

  1. Rapid experimental measurements of physicochemical properties to inform models and testing

    Article • The Science of The Total Environment, September 2018, Elsevier

    Dr Antony John Williams, Dr kamel mansouri, Dr John Fredrick Wambaugh

  2. Evaluating opportunities for advancing the use of alternative methods in risk assessment through the development of fit-for-purpose in vitro assays

    Article • Toxicology in Vitro, April 2018, Elsevier

    Dr kamel mansouri, Dr Antony John Williams

  3. OPERA models for predicting physicochemical properties and environmental fate endpoints

    Article • Journal of Cheminformatics, March 2018, Springer Science + Business Media

    Dr kamel mansouri, Dr Antony John Williams

  4. Suspect screening and non-targeted analysis of drinking water using point-of-use filters

    Article • Environmental Pollution, March 2018, Elsevier

    Dr Antony John Williams, Andrew D McEachran, Dr Seth R Newton, Dr kamel mansouri

  5. High-throughput in-silico prediction of ionization equilibria for pharmacokinetic modeling

    Article • The Science of The Total Environment, February 2018, Elsevier

    Dr John Fredrick Wambaugh, Dr kamel mansouri, Dr Antony John Williams

  6. The CompTox Chemistry Dashboard: a community data resource for environmental chemistry

    Article • Journal of Cheminformatics, November 2017, Springer Science + Business Media

    Dr Antony John Williams, Andrew D McEachran, Dr John Fredrick Wambaugh, Dr kamel mansouri, Dr Grace Patlewicz

  7. A systematic evaluation of analogs and automated read-across prediction of estrogenicity: A case study using hindered phenols

    Article • Computational Toxicology, November 2017, Elsevier

    Dr. Prachi Pradeep, Dr kamel mansouri, Dr Grace Patlewicz

  8. Predicting in vivo effect levels for repeat-dose systemic toxicity using chemical, biological, kinetic and study covariates

    Article • Archives of Toxicology, October 2017, Springer Science + Business Media

    Dr kamel mansouri, Dr Antony John Williams

  9. Predictive Structure-Based Toxicology Approaches To Assess the Androgenic Potential of Chemicals

    Article • Journal of Chemical Information and Computer Sciences, October 2017, American Chemical Society (ACS)

    Dr kamel mansouri, Dr Antony John Williams

  10. Machine Learning Approaches to Predict PhysChem Properties of Environmental Chemicals

    Article • Journal of Chemical Information and Computer Sciences, December 2016, American Chemical Society (ACS)

    Dr Antony John Williams, Dr Nicole Kleinstreuer, Dr kamel mansouri

  11. Prediction of Estrogenic Bioactivity of Environmental Chemical Metabolites

    Article • Chemical Research in Toxicology, September 2016, American Chemical Society (ACS)

    Dr Kamel Mansouri, Dr kamel mansouri, Dr Antony John Williams

  12. ToxCast Chemical Landscape: Paving the Road to 21st Century Toxicology

    Article • Chemical Research in Toxicology, July 2016, American Chemical Society (ACS)

    Dr Antony John Williams, Dr John Fredrick Wambaugh, Dr kamel mansouri, Jayaram Kancherla

  13. CERAPP: Collaborative Estrogen Receptor Activity Prediction Project

    Article • Environmental Health Perspectives, February 2016, Environmental Health Perspectives

    Dr kamel mansouri, Honorary Professor Roberto Todeschini, Jayaram Kancherla, Dr Antony John Williams

  14. In Silico Study of In Vitro GPCR Assays by QSAR Modeling

    Article • January 2016, Springer Science + Business Media

    Dr Kamel Mansouri, Dr kamel mansouri, Dr Antony John Williams

  15. Docking-based classification models for exploratory toxicology studies on high-quality estrogenic experimental data

    Article • Future Medicinal Chemistry, September 2015, Future Science

    Dr Kamel Mansouri, Dr kamel mansouri, Dr Antony John Williams

  16. Integrated Model of Chemical Perturbations of a Biological Pathway Using 18In VitroHigh-Throughput Screening Assays for the Estrogen Receptor

    Article • Toxicological Sciences, August 2015, Oxford University Press (OUP)

    Dr Keith Houck, Dr Kevin M Crofton, Dr kamel mansouri, Dr Antony John Williams

  17. Predicting Hepatotoxicity Using ToxCastin VitroBioactivity and Chemical Structure

    Article • Chemical Research in Toxicology, April 2015, American Chemical Society (ACS)

    Dr kamel mansouri, Dr Richard S Judson, Dr Russell S Thomas, Dr Kamel Mansouri, Dr Antony John Williams

  18. Quantitative Structure–Activity Relationship Models for Ready Biodegradability of Chemicals

    Article • Journal of Chemical Information and Computer Sciences, April 2013, American Chemical Society (ACS)

    Honorary Professor Roberto Todeschini, Dr kamel mansouri, Dr Kamel Mansouri, Dr Antony John Williams

  19. Assessing bioaccumulation of polybrominated diphenyl ethers for aquatic species by QSAR modeling

    Article • Chemosphere, October 2012, Elsevier

    Honorary Professor Roberto Todeschini, Dr kamel mansouri, Dr Kamel Mansouri, Dr Antony John Williams

  20. Comparison of Different Approaches to Define the Applicability Domain of QSAR Models

    Article • Molecules, April 2012, MDPI AG

    Honorary Professor Roberto Todeschini, Dr kamel mansouri, Dr Kamel Mansouri, Dr Antony John Williams