no code implementations • 21 Feb 2023 • Mohammad Sajjad Ghaemi, Hang Hu, Anguang Hu, Hsu Kiang Ooi
The continuous property of the latent space, which characterizes the discrete chemical structures, provides a flexible representation for inverse design in order to discover novel molecules.
no code implementations • 21 Feb 2023 • Hang Hu, Hsu Kiang Ooi, Mohammad Sajjad Ghaemi, Anguang Hu
Drug discovery is a complex process with a large molecular space to be considered.