Office of Research and Development Publications

National Center For Computational Toxicology (NCCT) Research Publications

Refine Your Search

Search Again

or try advanced search

Search Within

Records 1 to 25 of 116 Journal - Peer Reviewed Journals from [ORD-NCCT] published between 07/19/2013 and 07/19/2018

2018
McEachran, A., K. Mansouri, S. Newton, B. Beverly, J. Sobus, AND A. Williams. A comparison of three liquid chromatography (LC) retention time prediction models. TALANTA. Elsevier Science Ltd, New York, NY, 182:371-379, (2018). https://doi.org/10.1016/j.talanta.2018.01.022
Fitzpatrick, J., D. Roberts, AND G. Patlewicz. An evaluation of selected (Q)SARs/expert systems for predicting skin sensitisation potential. SAR AND QSAR IN ENVIRONMENTAL RESEARCH. Taylor & Francis, Inc., Philadelphia, PA, 29(6):439-468, (2018). https://doi.org/10.1080/1062936X.2018.1455223
Baker, N., A. Boobis, L. Burgoon, E. Carney, R. Currie, E. Fritsche, T. Knudsen, M. Laffont, A. Piersma, A. Poole, S. Schneider, AND G. Daston. Building a Developmental Toxicity Ontology. BIRTH DEFECTS RESEARCH PART B: DEVELOPMENTAL AND REPRODUCTIVE TOXICOLOGY. John Wiley & Sons, Ltd., Indianapolis, IN, 110(6):502-518, (2018). https://doi.org/10.1002/bdr2.1189
Mahapatra, D., Jill A. Franzosa, K. Roell, M. Kuenemann, Keith A. Houck, D. Reif, D. Fourches, AND S. Kullman. Confirmation of High-Throughput screening data and novel mechanistic insights into VDR-xenobiotic interactions by orthogonal assays. Scientific Reports. Nature Publishing Group, London, Uk, 8(8883):1-16, (2018). https://doi.org/10.1038/s41598-018-27055-3
Wambaugh, J., M. Hughes, C. Ring, D. MacMillan, J. Ford, T. Fennell, S. Black, R. Snyder, N. Sipes, B. Wetmore, J. Westerhout, Woodrow Setzer, R. Pearce, J. Simmons, AND R. Thomas. Evaluating In Vitro-In Vivo Extrapolation of Toxicokinetics. TOXICOLOGICAL SCIENCES. Society of Toxicology, RESTON, VA, 163(1):152-169, (2018). https://doi.org/10.1093/toxsci/kfy020
Strope, C., K. Mansouri, H. Clewell, J. Rabinowitz, C. Stevens, AND J. Wambaugh. High-Throughput in-silico prediction of ionization equilibria for pharmacokinetic modeling. SCIENCE OF THE TOTAL ENVIRONMENT. Elsevier BV, AMSTERDAM, Netherlands, 615:150-160, (2018). https://doi.org/10.1016/j.scitotenv.2017.09.033
Haggard, D., A. Karmaus, M. Martin, R. Judson, Woodrow Setzer, AND K. Paul-Friedman. High-throughput H295R steroidogenesis assay: utility as an alternative and a statistical approach to characterize effects on steroidogenesis. TOXICOLOGICAL SCIENCES. Society of Toxicology, RESTON, VA, 162(2):509-534, (2018). https://doi.org/10.1093/toxsci/kfx274
Bell, S., X. Chang, J. Wambaugh, D. Allen, M. Bartels, K. Brouwer, W. Casey, N. Choksi, S. Ferguson, G. Fraczkiewicz, A. Jarabek, A. Ke, A. Lumen, S. Lynn, A. Paini, Paul S Price, C. Ring, T. Simon, N. Sipes, C. Sprankle, J. Strickland, J. Troutman, B. Wetmore, AND N. Kleinstreuer. In vitro to in vivo extrapolation for high throughput prioritization and decision making. TOXICOLOGY IN VITRO. Elsevier Science Ltd, New York, NY, 47:213-227, (2018). https://doi.org/10.1016/j.tiv.2017.11.016
Roberts, D. AND G. Patlewicz. Non‐animal assessment of skin sensitization hazard: Is an integrated testing strategy needed, and if so what should be integrated? JOURNAL OF APPLIED TOXICOLOGY. John Wiley & Sons, Ltd., Indianapolis, IN, 38(1):41-50, (2017). https://doi.org/10.1002/jat.3479
Mansouri, K., C. Grulke, R. Judson, AND A. Williams. OPERA models for predicting physicochemical properties and environmental fate endpoints. Journal of Cheminformatics. Springer, New York, NY, 10:10, (2018). https://doi.org/10.1186/s13321-018-0263-1
Truong, L., G. Ouedraogo, L. Pham, J. Clouzeau, S. Loisel-Joubert, D. Blanchet, H. Noçairi, Woodrow Setzer, R. Judson, Chris Grulke, K. Mansouri, AND M. Martin. Predicting In Vivo Effect Levels for Repeat Dose Systemic Toxicity using Chemical, Biological, Kinetic and Study Covariates. Archives of Toxicology. Springer, New York, NY, 92(2):587-600, (2018).
Nicolas, C., K. Mansouri, K. Phillips, Chris Grulke, A. Richard, A. Williams, J. Rabinowitz, K. Isaacs, A. Yau, AND J. Wambaugh. Rapid Experimental Estimates of Physicochemical Properties to Inform Models and Testing. ENVIRONMENTAL SCIENCE & TECHNOLOGY. American Chemical Society, Washington, DC, 636:901-909, (2018). https://doi.org/10.1016/j.scitotenv.2018.04.266
Scialli, A., G. Daston, C. Chen, P. Coder, S. Euling, J. Foreman, A. Hoberman, J. Hui, T. Knudsen, S. Makris, L. Morford, A. Piersma, D. Stanislaus, AND K. Thompson. Rethinking Developmental Toxicity Testing: Evolution or Revolution? Birth Defects Research. John Wiley & Sons, Inc., Hoboken, NJ, 110(10):840-850, (2018). https://doi.org/10.1002/bdr2.1212
Phillips, K., A. Yau, K. Favela, K. Isaacs, A. McEachran, Chris Grulke, A. Richard, A. Williams, J. Sobus, R. Thomas, AND J. Wambaugh. Suspect Screening Analysis of Chemicals in Consumer Products. ENVIRONMENTAL SCIENCE & TECHNOLOGY. American Chemical Society, Washington, DC, 52(5):3125-3135, (2018). https://doi.org/10.1021/acs.est.7b04781
Chiu, W., K. Guyton, M. Martin, D. Reif, AND I. Rusyn. Use of High-throughput in vitro toxicity screening data in cancer hazard evaluations by the IARC Monograph Working Groups. ALTEX. Society ALTEX Edition, Kuesnacht, Switzerland, 35(1):51-64, (2018). https://doi.org/10.14573/altex.1703231
Nguyen, E., W. Daly, N. Le, M. Farnoodian, D. Belair, M. Schwartz, C. Lebakken, G. Ananiev, M. Saghiri, T. Knudsen, N. Sheibani, AND W. Murphy. Versatile synthetic alternatives to Matrigel for vascular toxicity screening and stem cell expansion. Nature Communications. Nature Publishing Group, London, Uk, 1(0096):1-34, (2018). https://doi.org/10.1038/s41551-017-0096
DeGroot, D., A. Swank, R. Thomas, M. Strynar, M. Lee, P. Carmichael, AND Steve Simmons. mRNA transfection retrofits cell-based assays with xenobiotic metabolism. JOURNAL OF PHARMACOLOGICAL & TOXICOLOGICAL METHODS. Elsevier Science Ltd, New York, NY, 92:77-94, (2018). https://doi.org/10.1016/j.vascn.2018.03.002
2017
McCollum, C., J. Conde Vancells, C. Hans, M. Vazquez-Chantada, N. Kleinstreuer, T. Tal, T. Knudsen, S. Shah, F. Merchant, R. Finnell, J. Gustafsson, R. Cabrera, AND M. Bondesson. Identification of vascular disruptor compounds by analysis in zebrafish embryos and mouse embryonic endothelial cells. REPRODUCTIVE TOXICOLOGY. Elsevier Science Ltd, New York, NY, 70:60-69, (2017).
Zang, Q., K. Mansouri, A. Williams, R. Judson, D. Allen, W. Casey, AND N. Kleinstreuer. In Silico Prediction of Physicochemical Properties of Environmental Chemicals Using Molecular Fingerprints and Machine Learning. Journal of Chemical Information and Modeling. American Chemical Society, Washington, DC, 57(1):36-49, (2017).
Kapraun, Dustin F., John F. Wambaugh, C. Ring, R. Tornero-Velez, AND R. Woodrow Setzer. A Method for Identifying Prevalent Chemical Combinations in the US Population. ENVIRONMENTAL HEALTH PERSPECTIVES. National Institute of Environmental Health Sciences (NIEHS), Research Triangle Park, NC, 125(8):1-16, (2017).
Pradeep, P., K. Mansouri, G. Patlewicz, AND R. Judson. A systematic evaluation of analogs and automated read-across prediction of estrogenicity: A case study using hindered phenols. Computational Toxicology. Elsevier B.V., Amsterdam, Netherlands, 4:22-30, (2017).
Baker, N., T. Knudsen, AND A. Williams. Abstract Sifter: a comprehensive front-end system to PubMed. F1000 Research. Faculty of 1000, London, Uk, 6:1-10, (2017). https://doi.org/10.12688/f1000research.12865.1
Malloy, T., V. Zaunbrecher, E. Beryt, R. Judson, R. Tice, P. Allard, A. Blake, I. Cote, H. Godwin, L. Heine, P. Kerzic, J. Kostal, G. Marchant, J. McPartland, K. Moran, A. Nel, O. Ogunseitan, M. Rossi, K. Thayer, J. Tickner, M. Whittaker, AND K. Zarker. Advancing Alternatives Analysis: The Role of Predictive Toxicology in Selecting Safer Chemical Products and Processes. Integrated Environmental Assessment and Management. Allen Press, Inc., Lawrence, KS, 13(5):915-925, (2017). https://doi.org/10.1002/ieam.1923
Sipes, N., J. Wambaugh, R. Pearce, S. Auerbach, B. Wetmore, J. Hsieh, A. Shapiro, D. Sboboda, M. DeVito, AND S. Ferguson. An Intuitive Approach for Predicting Human Risk with the Tox21 10k Library. ENVIRONMENTAL SCIENCE & TECHNOLOGY. American Chemical Society, Washington, DC, (51):10786-10796, (2017).
Fitzpatrick, J. AND G. Patlewicz. Application of IATA - A case study in evaluating the global and local performance of a Bayesian Network model for Skin Sensitization. SAR AND QSAR IN ENVIRONMENTAL RESEARCH. Taylor & Francis, Inc., Philadelphia, PA, 28(4):297-310, (2017).