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64 PR articles • 6,780 PR citations • Sorted by year • Download PDF (PDF by citations)
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1Evaluation of Per- and Polyfluoroalkyl Substances (PFAS) <i>In Vitro</i> Toxicity Testing for Developmental Neurotoxicity
Chemical Research in Toxicology, 2023, 36, 402-419
3.751Citations (PDF)
2A New CSRML Structure-Based Fingerprint Method for Profiling and Categorizing Per- and Polyfluoroalkyl Substances (PFAS)
Chemical Research in Toxicology, 2023, 36, 508-534
3.725Citations (PDF)
3Identification of Branched and Linear Forms of PFOA and Potential Precursors: A User-Friendly SMILES Structure-based Approach
Frontiers in Environmental Science, 2022, 10,
3.333Citations (PDF)
4Wikipedia on the CompTox Chemicals Dashboard: Connecting Resources to Enrich Public Chemical Data
Journal of Chemical Information and Modeling, 2022, 62, 4888-4905
4.58Citations (PDF)
5The Tox21 10K Compound Library: Collaborative Chemistry Advancing Toxicology
Chemical Research in Toxicology, 2021, 34, 189-216
3.7266Citations (PDF)
6Expanded high-throughput screening and chemotype-enrichment analysis of the phase II: e1k ToxCast library for human sodium-iodide symporter (NIS) inhibition
Archives of Toxicology, 2021, 95, 1723-1737
6.122Citations (PDF)
7Bioactivity profiling of per- and polyfluoroalkyl substances (PFAS) identifies potential toxicity pathways related to molecular structure
Toxicology, 2021, 457, 152789
4.8111Citations (PDF)
8Predicting compound amenability with liquid chromatography-mass spectrometry to improve non-targeted analysis
Analytical and Bioanalytical Chemistry, 2021, 413, 7495-7508
3.529Citations (PDF)
9Utility of In Vitro Bioactivity as a Lower Bound Estimate of In Vivo Adverse Effect Levels and in Risk-Based Prioritization
Toxicological Sciences, 2020, 173, 202-225
3.8222Citations (PDF)
10CoMPARA: Collaborative Modeling Project for Androgen Receptor Activity
Environmental Health Perspectives, 2020, 128,
8.8180Citations (PDF)
11EPA’s DSSTox database: History of development of a curated chemistry resource supporting computational toxicology research
Computational Toxicology, 2019, 12, 100096
3.0178Citations (PDF)
12The Next Generation Blueprint of Computational Toxicology at the U.S. Environmental Protection Agency
Toxicological Sciences, 2019, 169, 317-332
3.8338Citations (PDF)
13High-throughput screening and chemotype-enrichment analysis of ToxCast phase II chemicals evaluated for human sodium-iodide symporter (NIS) inhibition
Environment International, 2019, 126, 377-386
10.360Citations (PDF)
14Using prepared mixtures of ToxCast chemicals to evaluate non-targeted analysis (NTA) method performance
Analytical and Bioanalytical Chemistry, 2019, 411, 835-851
3.564Citations (PDF)
15Concentration–response evaluation of ToxCast compounds for multivariate activity patterns of neural network function
Archives of Toxicology, 2019, 94, 469-484
6.147Citations (PDF)
16Suspect Screening Analysis of Chemicals in Consumer Products
Environmental Science &amp; Technology, 2018, 52, 3125-3135
11.1115Citations (PDF)
17Rapid experimental measurements of physicochemical properties to inform models and testing
Science of the Total Environment, 2018, 636, 901-909
8.421Citations (PDF)
18A mechanistic framework for integrating chemical structure and high-throughput screening results to improve toxicity predictions
Computational Toxicology, 2018, 8, 1-12
3.015Citations (PDF)
19EPA’s non-targeted analysis collaborative trial (ENTACT): genesis, design, and initial findings
Analytical and Bioanalytical Chemistry, 2018, 411, 853-866
3.5139Citations (PDF)
20The CompTox Chemistry Dashboard: a community data resource for environmental chemistry
Journal of Cheminformatics, 2017, 9,
5.5997Citations (PDF)
21Integrating tools for non-targeted analysis research and chemical safety evaluations at the US EPA
Journal of Exposure Science and Environmental Epidemiology, 2017, 28, 411-426
4.1189Citations (PDF)
22Screening the ToxCast phase II libraries for alterations in network function using cortical neurons grown on multi-well microelectrode array (mwMEA) plates
Archives of Toxicology, 2017, 92, 487-500
6.167Citations (PDF)
23CERAPP: Collaborative Estrogen Receptor Activity Prediction Project
Environmental Health Perspectives, 2016, 124, 1023-1033
8.8339Citations (PDF)
24Using ToxCast™ Data to Reconstruct Dynamic Cell State Trajectories and Estimate Toxicological Points of Departure
Environmental Health Perspectives, 2016, 124, 910-919
8.872Citations (PDF)
25Editor's Highlight: Analysis of the Effects of Cell Stress and Cytotoxicity on<i>In Vitro</i>Assay Activity Across a Diverse Chemical and Assay Space
Toxicological Sciences, 2016, 152, 323-339
3.8220Citations (PDF)
26Linking high resolution mass spectrometry data with exposure and toxicity forecasts to advance high-throughput environmental monitoring
Environment International, 2016, 88, 269-280
10.3178Citations (PDF)
27Integrated Model of Chemical Perturbations of a Biological Pathway Using 18<i>In Vitro</i>High-Throughput Screening Assays for the Estrogen Receptor
Toxicological Sciences, 2015, 148, 137-154
3.8293Citations (PDF)
28Phenotypic screening of the ToxCast chemical library to classify toxic and therapeutic mechanisms
Nature Biotechnology, 2014, 32, 583-591
32.2196Citations (PDF)
29EADB: An Estrogenic Activity Database for Assessing Potential Endocrine Activity
Toxicological Sciences, 2013, 135, 277-291
3.877Citations (PDF)
30The new revolution in toxicology: The good, the bad, and the ugly
Annals of the New York Academy of Sciences, 2013, 1278, 11-24
4.123Citations (PDF)
31Profiling 976 ToxCast Chemicals across 331 Enzymatic and Receptor Signaling Assays
Chemical Research in Toxicology, 2013, 26, 878-895
3.7187Citations (PDF)
32Real-Time Growth Kinetics Measuring Hormone Mimicry for ToxCast Chemicals in T-47D Human Ductal Carcinoma Cells
Chemical Research in Toxicology, 2013, 26, 1097-1107
3.745Citations (PDF)
33Aggregating Data for Computational Toxicology Applications: The U.S. Environmental Protection Agency (EPA) Aggregated Computational Toxicology Resource (ACToR) System
International Journal of Molecular Sciences, 2012, 13, 1805-1831
4.5106Citations (PDF)
34Integration of Dosimetry, Exposure, and High-Throughput Screening Data in Chemical Toxicity Assessment
Toxicological Sciences, 2012, 125, 157-174
3.8386Citations (PDF)
35Genetic toxicology in the 21st century: Reflections and future directions
Environmental and Molecular Mutagenesis, 2011, 52, 339-354
2.196Citations (PDF)
36Activity profiles of 309 ToxCast™ chemicals evaluated across 292 biochemical targets
Toxicology, 2011, 282, 1-15
4.8135Citations (PDF)
37<i>In Vitro</i> Screening of Environmental Chemicals for Targeted Testing Prioritization: The ToxCast Project
Environmental Health Perspectives, 2010, 118, 485-492
8.8567Citations (PDF)
38Endocrine Profiling and Prioritization of Environmental Chemicals Using ToxCast Data
Environmental Health Perspectives, 2010, 118, 1714-1720
8.8347Citations (PDF)
39Impact of Environmental Chemicals on Key Transcription Regulators and Correlation to Toxicity End Points within EPA’s ToxCast Program
Chemical Research in Toxicology, 2010, 23, 578-590
3.7210Citations (PDF)
40DSSTox chemical-index files for exposure-related experiments in ArrayExpress and Gene Expression Omnibus: enabling toxico-chemogenomics data linkages
Bioinformatics, 2009, 25, 692-694
4.822Citations (PDF)
41Toward a Public Toxicogenomics Capability for Supporting Predictive Toxicology: Survey of Current Resources and Chemical Indexing of Experiments in GEO and ArrayExpress
Toxicological Sciences, 2009, 109, 358-371
3.824Citations (PDF)
42Toxicity Data Informatics: Supporting a New Paradigm for Toxicity Prediction
Toxicology Mechanisms and Methods, 2008, 18, 103-118
2.971Citations (PDF)
43The ToxCast Program for Prioritizing Toxicity Testing of Environmental Chemicals
Toxicological Sciences, 2007, 95, 5-12
3.8957Citations (PDF)
44The Art of Data Mining the Minefields of Toxicity Databases to Link Chemistry to Biology
Current Computer-Aided Drug Design, 2006, 2, 135-150
1.034Citations (PDF)
45Identification and Characterization of Novel Stable Deoxyguanosine and Deoxyadenosine Adducts of Benzo[a]pyrene-7,8-quinone from Reactions at Physiological pH
Chemical Research in Toxicology, 2004, 17, 827-838
3.773Citations (PDF)
46Interaction of organophosphate pesticides and related compounds with the androgen receptor.
Environmental Health Perspectives, 2003, 111, 545-552
8.852Citations (PDF)
47Distributed structure-searchable toxicity (DSSTox) public database network: a proposal
Mutation Research - Fundamental and Molecular Mechanisms of Mutagenesis, 2002, 499, 27-52
1.8151Citations (PDF)
48An Evaluation of the Mutagenicity, Metabolism, and DNA Adduct Formation of 5-Nitrobenzo[b]naphtho[2,1-d]thiophene
Chemical Research in Toxicology, 2001, 14, 661-671
3.716Citations (PDF)
49Theoretical Study of the SNV Reaction of Trichloroethylene (TCE) and CH3S- as a Model for Glutathione Conjugation of TCE
Chemical Research in Toxicology, 1999, 12, 308-316
3.710Citations (PDF)
50Application of artificial intelligence and computer-based methods to predicting chemical toxicity
Knowledge Engineering Review, 1999, 14, 307-317
1.117Citations (PDF)
51Structure-based methods for predicting mutagenicity and carcinogenicity: are we there yet?
Mutation Research - Fundamental and Molecular Mechanisms of Mutagenesis, 1998, 400, 493-507
1.879Citations (PDF)
52Quantitative Structure-Based Modeling Applied to Characterization and Prediction of Chemical Toxicity
Methods, 1998, 14, 264-276
3.649Citations (PDF)
53Theoretical Evaluation of Two Plausible Routes for Bioactivation of S-(1,1-Difluoro-2,2-dihaloethyl)-l-cysteine Conjugates:  Thiirane vs Thionoacyl Fluoride Pathway
Chemical Research in Toxicology, 1997, 10, 103-110
3.717Citations (PDF)
54The Development and Validation of Expert Systems for Predicting Toxicity
ATLA Alternatives To Laboratory Animals, 1997, 25, 223-251
2.298Citations (PDF)
55Conformational Aspects of Glutathione Conjugates of Chlorinated Alkenes:  A Computational Study
Chemical Research in Toxicology, 1996, 9, 667-675
3.72Citations (PDF)
56QSARS of mutagens and carcinogens: Two case studies illustrating problems in the construction of models for noncongeneric chemicals
Mutation Research - Genetic Toxicology Testing and Biomonitoring of Environmental Or Occupational Exposure, 1996, 371, 29-46
1.346Citations (PDF)
57Quantitative structure-activity relationships for the developmental toxicity of haloacetic acids in mammalian whole embryo culture
1996, 53, 352-360
68Citations (PDF)
58Synthesis and Characterization of Adducts of Alachlor and 2-Chloro-N-(2,6-diethylphenyl)acetamide with 2'-Deoxyguanosine, Thymidine, and Their 3'-Monophosphates
Chemical Research in Toxicology, 1995, 8, 209-217
3.715Citations (PDF)
59Role of computational chemistry in support of hazard identification (ID): mechanism-based SARs
Toxicology Letters, 1995, 79, 115-122
0.66Citations (PDF)
60Structure-activity study of paracetamol analogs: inhibition of replicative DNA synthesis in V79 Chinese hamster cells
Chemical Research in Toxicology, 1991, 4, 151-156
3.727Citations (PDF)
61Quantitative comparison of molecular electrostatic potentials for structure-activity studies
Journal of Computational Chemistry, 1991, 12, 959-969
4.970Citations (PDF)
62A CASE-SAR analysis of polycyclic aromatic hydrocarbon carcinogenicity
Mutation Research - Genetic Toxicology Testing and Biomonitoring of Environmental Or Occupational Exposure, 1990, 242, 285-303
1.333Citations (PDF)
63Modified molecular charge similarity indices for choosing molecular analogues
International Journal of Quantum Chemistry, 1987, 31, 309-323
2.018Citations (PDF)
64Photodissociation of the energy selected nitrobenzene ion
Journal of Chemical Physics, 1986, 84, 1424-1431
2.816Citations (PDF)