Big Opportunity for Artificial Intelligence
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q A massive of data has been generated in the biomedical domain
q Many data are Graph-Structured
Gaudelet, T., Day, B., Jamasb, A. R., Soman, J., Regep, C., Liu, G., ... & Taylor-King, J. P. (2021). Utilizing graph machine
learning within drug discovery and development. Briefings in bioinformatics, 22(6), bbab159
ChEMBL Dataset (Figure from ChEMBL’s homepage.)
Illustration of a molecular and protein, as well
as their graph representation.
(Figure from Gaudelet et al.)
