AI-powered
podcast player
Listen to all your favourite podcasts with AI-powered features
Drug Discovery - What's a Drug?
What do graphs even represent in this space? And what's a drug? Okay, so let's say you think that there are many different types of drugs. The molecule is just where the node in the graph is an atom and then you have the bond. So it's really a graph representation if you look in the D in 2D, correct? Yeah. You can do it 3D but let's keep it simple and stick in 2D.