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cmelab · Jul 11, 2024 · aa970be · aa970be
1 parent 18b1529
commit aa970be
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/containers/icomse/dockerfile_icomse b/containers/icomse/dockerfile_icomse
@@ -5,7 +5,7 @@ ENV CONDA_OVERRIDE_CUDA="12.0"
 RUN conda update -n base -c defaults conda && \
     conda info && \
     conda install libarchive mamba -n base -c conda-forge && \
-    mamba install -c conda-forge "hoomd=4.7.0=*gpu*" "cuda-version=12.0"  vim openssh mbuild gsd ipython ipykernel mdanalysis foyer freud ipywidgets scipy numpy physical_validation matplotlib jupyter pandas flowermd nglview mdanalysis openff-toolkit
+    mamba install -c conda-forge "hoomd=4.7.0=*gpu*" "cuda-version=12.0"  vim openssh mbuild gsd ipython ipykernel mdanalysis foyer freud ipywidgets scipy numpy physical_validation matplotlib jupyter pandas flowermd nglview mdanalysis libarchive openff-toolkit
 
 # configure unprivileged user
 RUN useradd --create-home --shell /bin/bash icomse-software