Developing machine learning models from protein-ligand interactions
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16 months ago
fawazfebin ▴ 100

Hi

Suppose that after screening libraries of drug molecules, I have a list of active compounds that docks into the protein. Is it possible to develop a machine learning model for those compounds that have the desired activity? Where can I get the guidance for the same?

I would really appreciate any help.

Febin

ligand protein docking machine learning • 308 views
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