Merge pull request #179 from OpenFreeEnergy/update_to_openfe_1.2

bumping to openfe v1.2.0
OpenFreeEnergy · Nov 19, 2024 · dc61e8d · dc61e8d
2 parents ee99700 + cd09d81
commit dc61e8d
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diff --git a/.binder/environment.yml b/.binder/environment.yml
@@ -28,5 +28,5 @@ dependencies:
   - rdkit
   - typing_extensions
   - gufe>=0.9.4
-  - openfe~=1.0
+  - openfe~=1.2
   - py3dmol
diff --git a/showcase/openfe_showcase.ipynb b/showcase/openfe_showcase.ipynb
@@ -88,7 +88,7 @@
     "if \"COLAB_RELEASE_TAG\" in os.environ:\n",
     "    !pip install -q condacolab\n",
     "    import condacolab\n",
-    "    condacolab.install_from_url(\"https://github.com/OpenFreeEnergy/openfe/releases/download/v1.1.0/OpenFEforge-1.1.0-Linux-x86_64.sh\")"
+    "    condacolab.install_from_url(\"https://github.com/OpenFreeEnergy/openfe/releases/download/v1.2.0/OpenFEforge-1.2.0-Linux-x86_64.sh\")"
    ]
   },
   {