HIGHLIGHTS
- who: Doha Naga from the (UNIVERSITY) have published the paper: Off-targetP ML: an open source machine learning framework for off-target panel safety assessment of small molecules, in the Journal: (JOURNAL)
- what: Throughout the workflow development the authors explore and compare the capability of Neural Networks and AutoML in constructing prediction models for fifty off-targets of different protein classes different dataset sizes and high-class imbalance. Preclinical toxicity has been identified as one of the major reasons behind the failures of candidates in the early phases of drug development . The balanced accuracy values . . .
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