Create app.py

app.py

@@ -0,0 +1,11 @@
+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()