Graphical abstract (IMAGE)
Caption
Using machine learning techniques, scientists selected the most promising virtual chemical structures from thousands of molecules, and then obtained or synthesized them before testing in vitro (in a test tube) five promising molecules that would become contenders for a future drug. All five compounds were active, but one showed the most promising activity.
Credit
Gawriljuk et al. / J. Chem. Inf. Model., 2021
Usage Restrictions
Can be used only with obligation of quoting the source: Gawriljuk et al. / J. Chem. Inf. Model., 2021
License
Original content