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Similarity-Based Methods and Machine Learning Approaches for Target Prediction in Early Drug Discovery: Performance and Scope

Computational methods for predicting the macromolecular targets of drugs and drug-like compounds have evolved as a key technology in drug discovery. However, the established validation protocols leave several key questions regarding the performance and scope of methods unaddressed. For example, pred...

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Foilsithe in:Int J Mol Sci
Main Authors: Mathai, Neann, Kirchmair, Johannes
Formáid: Artigo
Teanga:Inglês
Foilsithe: MDPI 2020
Ábhair:
Rochtain Ar Líne:https://ncbi.nlm.nih.gov/pmc/articles/PMC7279241/
https://ncbi.nlm.nih.gov/pubmed/32438666
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms21103585
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