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Documentation including certificates of analysis are available upon request for research validation purposes to support institutional compliance and grant requirements

In order to select the appropriate model, we employed an objective function comprised of specificity values, the proportion of true negatives identified within decoys excluded from training, the percentage of active compounds identified from the family, and the percentage of compounds from the binding database not associated with the family, then we established an ML model for each family, as delineated in Table 4

This could be beneficial in the treatment of brain injuries or neurodegenerative diseases

Animal studies do not always capture subtle or long-term adverse effects that might manifest in humans