In a little over 2 minutes, I will be explaining how Machine Learning can be used for Drug Discovery. I'll be providing a high-level explanation of this field which is known as Quantitative Structure-Activity Relationship (QSAR). Particularly, chemical structures of compounds are correlated to their biological activity (constituting the action of drugs).
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👇 Selected Papers I've written on QSAR
✅ A practical overview of quantitative structure-activity relationship [ Ссылка ]
✅ Best Practices for Constructing Reproducible QSAR Models [ Ссылка ]
✅ Towards the Revival of Interpretable QSAR Models [ Ссылка ]
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Machine Learning for Drug Discovery (Explained in 2 minutes)
Теги
QSARHow to QSARWhat is QSARQSPRWhat is QSPRquantitative structure-activity relationshipquantitative structure-property relationshipMachine learningData scienceDrug discoveryComputational drug discoveryComputer-aided drug discoveryComputer-aided drug designDrug designComputational biologyCheminformaticsComputational chemistryCheminformaticBioinformaticsBioinformaticMachine learning for drug discoveryMachine learning in drug discovery