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Computational Toxicology in EPA
2017Presentation in Iowa City at ...
0000-0003-1749-9971, Crofton, Kevin
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Predictive Models and Computational Toxicology
2012Understanding the potential health risks posed by environmental chemicals is a significant challenge elevated by the large number of diverse chemicals with generally uncharacterized exposures, mechanisms, and toxicities. The ToxCast computational toxicology research program was launched by EPA in 2007 and is part of the federal Tox21 consortium to ...
Richard S. Judson +5 more
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ACToR — Aggregated Computational Toxicology Resource
Toxicology and Applied Pharmacology, 2008ACToR (Aggregated Computational Toxicology Resource) is a database and set of software applications that bring into one central location many types and sources of data on environmental chemicals. Currently, the ACToR chemical database contains information on chemical structure, in vitro bioassays and in vivo toxicology assays derived from more than 150
Richard M. Spencer +9 more
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Is computational toxicology withering on the vine?
Archives of Toxicology, 2010The difficulties of developing predictive computational models of toxicity are discussed in relation to their internal and external validation, the selection of relevant physicochemical data and the need to characterise the structure-activity relationship landscapes obtained with training sets of chemicals by using recently published methods.
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Adventures in Computational Toxicology and Exposure
2017Presented to Bristol-Meyers ...
Kapraun, Dustin, 0000-0001-5570-6383
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Application of a digital computer to emergency toxicology
Clinica Chimica Acta, 1974Abstract A digital computer has been applied to the laboratory diagnosis of drug overdose. Analytic data is entered by the technologist at a keyboard in response to computer instructions. Major and minor ultraviolet absorption peaks, pH dependent spectral shifts, and peak absorbance ratios are used for decision making.
Peter Jatlow, David Seligson
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[The development of computational toxicology and application in risk assessment of chemicals].
Zhonghua yu fang yi xue za zhi [Chinese journal of preventive medicine], 2019The number of new chemicals increases tremendously annually, while traditional time-and cost-consuming toxicity tests based on animals with the uncertainty of extrapolation could not meet the demand of hazard identification and risk assessment.
R. Zhang, W. Chen
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Computational Toxicology: Application in Environmental Chemicals
2012This chapter provides an overview of computational models that describe various aspects of the source-to-health effect continuum. Fate and transport models describe the release, transportation, and transformation of chemicals from sources of emission throughout the general environment.
Curtis C. Dary +6 more
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Applicability of Computational Systems Biology in Toxicology
Basic & Clinical Pharmacology & Toxicology, 2014AbstractSystems biology as a research field has emerged within the last few decades. Systems biology, often defined as the antithesis of the reductionist approach, integrates information about individual components of a biological system. In integrative systems biology, large data sets from various sources and databases are used to model and predict ...
Niels Hadrup +3 more
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Computational toxicology in drug safety research
Folia Pharmacologica Japonica, 2023The progress of computational toxicology (CompTox) in drug safety research is highly anticipated. CompTox provides toxicity screening methods for drug discovery in the early stages. CompTox also contributes to fostering the application of the principles of the 3Rs in toxicity testing by expanding non-animal test methods.
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