Use newer GROMACS build

openforcefield · Jan 2, 2024 · 61ed255 · 61ed255
1 parent 583bac3
commit 61ed255
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/devtools/conda-envs/full.yaml b/devtools/conda-envs/full.yaml
@@ -22,7 +22,7 @@ dependencies:
   - qcportal
   - qcengine
   - openeye-toolkits
-  - gromacs =2023.3=nompi_*_101
+  - gromacs =2023.3=nompi_*_103
   - intermol
   - pip:
     - git+https://github.com/openforcefield/openff-toolkit.git@main