| import gradio as gr | |
| import cg2all | |
| def runner(in_pdb, model_type): | |
| out_fn = in_pdb.name[:-4] + "-all.pdb" | |
| cg2all.convert_cg2all(in_pdb.name, out_fn, model_type=model_type) | |
| demo = gr.Interface(fn=cg2all.convert_cg2all, | |
| inputs=[gr.File("Upload a coarse-grained PDB file"), gr.Radio(["CalphaBasedModel", "ResidueBasedModel", "Martini"])], | |
| outputs=[gr.File("Download the converted all-atom PDB file")]) | |
| demo.launch() |