dockerfile.run – g

g_bundle

Molecular dynamics simulator, with building and analysis tools

Debian

RUN apt-get update && \
    apt-get install -y gromacs

Ubuntu

RUN apt-get update && \
    apt-get install -y gromacs

Kali Linux

RUN apt-get update && \
    apt-get install -y gromacs

Fedora

RUN dnf install -y gromacs

Raspbian

RUN apt-get update && \
    apt-get install -y gromacs

click the source code to copy install g_bundle on any operating system with command-not-found.com