Development of a consumer product ingredient database for chemical exposure screening and prioritization MR Goldsmith, CM Grulke, RD Brooks, TR Transue, YM Tan, A Frame, ...
Food and chemical toxicology 65, 269-279, 2014
123 2014 A Pharmacokinetic Model of cis - and trans -Permethrin Disposition in Rats and Humans With Aggregate Exposure Application R Tornero-Velez, J Davis, EJ Scollon, JM Starr, RW Setzer, MR Goldsmith, ...
Toxicological Sciences 130 (1), 33-47, 2012
71 2012 Developing a physiologically-based pharmacokinetic model knowledgebase in support of provisional model construction J Lu, MR Goldsmith, CM Grulke, DT Chang, RD Brooks, JA Leonard, ...
PLoS computational biology 12 (2), e1004495, 2016
51 2016 Reconstructing human exposures using biomarkers and other “clues” YM Tan, J Sobus, D Chang, R Tornero-Velez, M Goldsmith, J Pleil, C Dary
Journal of Toxicology and Environmental Health, Part B 15 (1), 22-38, 2012
50 2012 Parameters for pyrethroid insecticide QSAR and PBPK/PD models for human risk assessment JB Knaak, CC Dary, X Zhang, RW Gerlach, R Tornero-Velez, DT Chang, ...
Reviews of environmental contamination and toxicology, 1-114, 2012
41 2012 Self-consistent polarization neglect of diatomic differential overlap: Application to water clusters DT Chang, GK Schenter, BC Garrett
The Journal of chemical physics 128 (16), 2008
33 2008 A Workflow to Investigate Exposure and Pharmacokinetic Influences on High-Throughput in Vitro Chemical Screening Based on Adverse Outcome Pathways MB Phillips, JA Leonard, CM Grulke, DT Chang, SW Edwards, R Brooks, ...
Environmental health perspectives 124 (1), 53-60, 2016
29 2016 Evaluation of quantitative structure property relationship algorithms for predicting plasma protein binding in humans YE Yun, R Tornero-Velez, ST Purucker, DT Chang, AN Edginton
Computational Toxicology 17, 100142, 2021
20 2021 First principles determination of the photoelectron spectrum of DT Chang, K Reimann, G Surratt, GI Gellene, P Lin, RR Lucchese
The Journal of chemical physics 117 (12), 5757-5763, 2002
14 2002 PAVA: physiological and anatomical visual analytics for mapping of tissue-specific concentration and time-course data MR Goldsmith, TR Transue, DT Chang, R Tornero-Velez, MS Breen, ...
Journal of pharmacokinetics and pharmacodynamics 37, 277-287, 2010
12 2010 An ab initio , analytically fitted, global potential energy surface for the ground electronic state of DT Chang, GI Gellene
The Journal of chemical physics 119 (9), 4694-4699, 2003
11 2003 Informing mechanistic toxicology with computational molecular models MR Goldsmith, SD Peterson, DT Chang, TR Transue, R Tornero-Velez, ...
Computational Toxicology: Volume I, 139-165, 2012
9 2012 Biomonitoring–An Exposure Science Tool for Exposure and Risk Assessment C Tan, CC Dary, D Chang, E Ulrich, JM Van Emon, J Xue, JD Pleil, ...
US Environmental Protection Agency: Washington, DC, USA, 2012
8 2012 Application of Cell Painting for chemical hazard evaluation in support of screening-level chemical assessments J Nyffeler, C Willis, FR Harris, MJ Foster, B Chambers, M Culbreth, ...
Toxicology and Applied Pharmacology 468, 116513, 2023
7 2023 Transparency in modeling through careful application of OECD’s QSAR/QSPR principles via a curated water solubility data set CN Lowe, N Charest, C Ramsland, DT Chang, TM Martin, AJ Williams
Chemical Research in Toxicology 36 (3), 465-478, 2023
7 2023 A workflow for identifying metabolically active chemicals to complement in vitro toxicity screening JA Leonard, C Stevens, K Mansouri, D Chang, H Pudukodu, S Smith, ...
Computational Toxicology 6, 71-83, 2018
6 2018 First principles determination of the bound levels of Li−(H2) DT Chang, G Surratt, G Ristroff, GI Gellene
The Journal of chemical physics 116 (21), 9188-9195, 2002
6 2002 Evaluating the impact of uncertainties in clearance and exposure when prioritizing chemicals screened in high-throughput assays JA Leonard, A Sobel Leonard, DT Chang, S Edwards, J Lu, S Scholle, ...
Environmental science & technology 50 (11), 5961-5971, 2016
5 2016 DockScreen: a database of in silico biomolecular interactions to support computational toxicology MR Goldsmith, CM Grulke, DT Chang, TR Transue, SB Little, ...
Dataset Papers in Science 2014, 2014
5 2014 In Silico Strategies for Modeling Stereoselective Metabolism of PyrethroidsDT Chang, MR Goldsmith, R Tornero-Velez, YM Tan, CM Grulke, LJ Chen, ...
Parameters for pesticide QSAR and PBPK/PD models for human risk assessment …, 2012
5 2012