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Appendix F: Data Science and Machine Learning
Pages 140-146

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From page 140...
... Although QSAR modeling has existed for a long time, it has advanced to a new stage with the recent progress of machine learning to deep learning. However, critical issues exist in the current computational toxicology models, such as reliance on small training sets which cause limited coverage by the resulting models (Stouch et al., 2003)
From page 141...
... IDENTIFYING INFLUENCES OF AIR QUALITY ON BIOLOGICAL AIR CONTAMINANTS EPA, through both intramural and extramural research portfolios, has contributed to the development of high-performance computational models of atmospheric photochemistry as it relates to secondary air pollutant formation, tropospheric smog, and the oxidizing species it contains. Although not currently regulated in the United States, the chemical composition of indoor environments including indoor air has increasingly been the subject of scientific research and health-effects exposure studies.
From page 142...
... Modeling environmental concentrations based on incomplete monitoring data is aided by GIS-based models that have comprehensive information about river flows at high and low seasonal volumes. These models can be used as the basis for estimating the concentrations of environmental chemicals released from wastewater treatment plants, with the models being validated by environmental sampling and analytical chemistry (McDonough et al., 2016)
From page 143...
... 2021. Revealing adverse outcome pathways from public high-throughput screening data to evaluate new toxicants by a knowledge based deep neural network approach.
From page 144...
... 2016. Mechanism profiling of hepatotoxicity caused by oxidative stress using antioxidant response element reporter gene assay models and big data.
From page 145...
... 2013. Development of an adverse outcome pathway from drug-mediated bile salt ex port pump inhibition to cholestatic liver injury.
From page 146...
... 2014. Big data in chemical toxicity research: The use of high-throughput screening assays to identify potential toxicants.


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