File: Dockerfile

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mopac 23.1.2-1
  • links: PTS, VCS
  • area: main
  • in suites: forky, sid, trixie
  • size: 115,604 kB
  • sloc: f90: 165,274; python: 202; sh: 181; ansic: 85; makefile: 8
file content (11 lines) | stat: -rw-r--r-- 398 bytes parent folder | download 
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FROM molssi/mamba141:latest
 
LABEL maintainer="Mohammad Mostafanejad, \
                  Molecular Sciences Software Institute"

RUN mamba install mopac \
    -c conda-forge -yq \
 && mamba clean -afy \
 && find ${CONDA_PREFIX} -follow -type f -name '*.a' -delete \
 && find ${CONDA_PREFIX} -follow -type f -name '*.pyc' -delete \
 && find ${CONDA_PREFIX} -follow -type f -name '*.js.map' -delete