plinder_inference_template

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Ninjani commited on Nov 25, 2024

Commit

462611b

1 Parent(s): 005faa8

fix true

Files changed (1) hide show

api-template.ipynb CHANGED Viewed

@@ -107,7 +107,7 @@
     "    receptor_file=handle_file(output_pdb),\n",
     "    ligand_file=handle_file(output_sdf),\n",
     "    api_name=\"/get_metrics\",\n",
-    "    flexible=False,\n",
     "    posebusters=True,\n",
     ")\n",
     "metrics, runtime = result\n",

     "    receptor_file=handle_file(output_pdb),\n",
     "    ligand_file=handle_file(output_sdf),\n",
     "    api_name=\"/get_metrics\",\n",
+    "    flexible=True,\n",
     "    posebusters=True,\n",
     ")\n",
     "metrics, runtime = result\n",