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Trying adjusted dockerfile
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Christopher Henry committed Nov 21, 2024
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2 changes: 1 addition & 1 deletion Dockerfile
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Expand Up @@ -10,6 +10,7 @@ MAINTAINER chenry@anl.gov
# https library that is out of date in the base image.

RUN pip install --upgrade pip
RUN pip install chemw==0.3.2

# update security libraries in the base image
RUN pip install cffi --upgrade \
Expand All @@ -31,7 +32,6 @@ RUN pip install --upgrade pip
RUN pip install "numpy<1.24"
RUN pip install cobra
RUN pip install networkx
RUN pip install chemw==0.3.2
RUN pip install deepdiff
RUN pip install h5py

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