DiffDock-Web
A Gradio demo from MIT researchers. DiffDock is a diffusion model for molecular docking & an increasing number of researchers are expected to be interested in using it. Servicing the model/demo through HuggingFace helps Scientists to share/explore the model easily.
Excited to finally be able to share our ICLR work critically analyzing the capacity of deep learning docking methods to generalize and how to improve this (spoiler scaling, augmentation and RL)! With this, we release a new significantly improved version of DiffDock!
A thread! 🧵