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More internal changes to handle running tasks,
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like MOPAC or LAMMPS, in a workflow run in a Docker image.
1. Installing Docker in the image.
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paulsaxe committed Feb 14, 2024
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FROM molssi/mamba141
RUN apt-get install -qy curl && curl -sSL https://get.docker.com/ | sh
COPY seamm.yml /root/seamm.yml
RUN mamba env update --name base --file /root/seamm.yml
WORKDIR /home
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