Visuals
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Predicted Toxicity Probability and Synthetic Accessibility
Toxicity and Synthetic Accessibility Scatterplot
Scatter plot of synthetic accessibility against toxicity probability for a quick view of easy to synthesize low toxicity compounds.
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Config
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Files
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Input Files
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Output Files
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Citations
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Michal, B. et al., eToxPred: a machine learning-based approach to estimate the toxicity of drug candidates, https://bmcpharmacoltoxicol.biomedcentral.com/, 08 January 2019, https://bmcpharmacoltoxicol.biomedcentral.com/articles/10.1186/s40360-018-0282-6. |
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Neurosnap Inc. (2022). Neurosnap: An online platform for computational biology and chemistry. Available at: https://neurosnap.ai/ |