DiffDock-Pocket-Web / run_utils.py

Commit History

Add license
247038e

Jacob Silterra commited on

Add UI inputs for pocket center x/y/z and flexible sidechains.
275b482

Jacob Silterra commited on

Improve logging
3ee7677

Jacob Silterra commited on

Display ligand (SDF) file as well as protein.
b1dc6ad

Jacob Silterra commited on

Complete overhaul of the UI.
5c0a4b6

Jacob Silterra commited on

Add ability to upload a YAML file with other arguments (all passed to inference.py).
0303515

Jacob Silterra commited on

Tweak output zip filename
47e84bb

Jacob Silterra commited on

Some reformatting and refactoring. Upgrade gradio to 3.50.
28fb149

Jacob Silterra commited on

Have gradio app call inference.py
6daa4cc

Jacob Silterra commited on