mdrun_openmpi_d
Molecular dynamics sim, binaries for OpenMPI parallelization
RUN apt-get update && \
apt-get install -y gromacs-openmpi
RUN apt-get update && \
apt-get install -y gromacs-openmpi
RUN apt-get update && \
apt-get install -y gromacs-openmpi
RUN dnf install -y gromacs-openmpi
RUN apt-get update && \
apt-get install -y gromacs-openmpi