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Found 2 papers, 1 papers with code
Validating the Validation: Reanalyzing a large-scale comparison of Deep Learning and Machine Learning models for bioactivity prediction
Machine learning methods may have the potential to significantly accelerate drug discovery.
Target Fishing: A Single-Label or Multi-Label Problem?
According to Cobanoglu et al and Murphy, it is now widely acknowledged that the single target paradigm (one protein or target, one disease, one drug) that has been the dominant premise in drug development in the recent past is untenable.
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