Information Panel for job 66df54fa3febf92a5522c0a4

Service: eTox Drug Toxicity Prediction

Status: completed

Runtime: 3s

Note:

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.

AI models produce responses and outputs through sophisticated algorithms and learning techniques, which may result in inaccuracies. By engaging with this model, you accept responsibility for any potential harm resulting from its responses or outputs.

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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.

Neurosnap Inc. (2022). Neurosnap: An online platform for computational biology and chemistry. Available at: https://neurosnap.ai/

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