How to Install and Uninstall gromacs-mpi Package on Ubuntu 22.04 LTS (Jammy Jellyfish)

Last updated: November 22,2024

You can also install and uninstall the gromacs-mpi on the following distributions in the same way, as they are all based on the Ubuntu system

Kubuntu 22.04 LTS
Lubuntu 22.04 LTS
Xubuntu 22.04 LTS
Ubuntu MATE 22.04 LTS
Ubuntu Studio 22.04 LTS
Pop!_OS 22.04 LTS
Zorin OS 16 / Zorin OS 17
Ubuntu Budgie 22.04

1. Install "gromacs-mpi" package

Please follow the instructions below to install gromacs-mpi on Ubuntu 22.04 LTS (Jammy Jellyfish)


    
        
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                sudo apt update
            
                    
    
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                sudo apt install
            
                        
                gromacs-mpi
            
                    
    
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2. Uninstall "gromacs-mpi" package

Please follow the instructions below to uninstall gromacs-mpi on Ubuntu 22.04 LTS (Jammy Jellyfish):


    
        
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                sudo apt remove
            
                        
                gromacs-mpi
            
                    
    
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                sudo apt autoclean && sudo apt autoremove
            
                    
    
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3. Information about the gromacs-mpi package on Ubuntu 22.04 LTS (Jammy Jellyfish)

Package: gromacs-mpi
Architecture: amd64
Version: 2021.4-2
Priority: optional
Section: universe/science
Source: gromacs
Origin: Ubuntu
Maintainer: Ubuntu Developers
Original-Maintainer: Debichem Team
Bugs: https://bugs.launchpad.net/ubuntu/+filebug
Installed-Size: 17283
Depends: mpi-default-bin, sse4.2-support, libc6 (>= 2.34), libfftw3-double3 (>= 3.3.5), libfftw3-single3 (>= 3.3.5), libgcc-s1 (>= 3.3.1), libgomp1 (>= 4.9), libhwloc15 (>= 2.6.0), libopenmpi3 (>= 4.1.0), libstdc++6 (>= 11), zlib1g (>= 1:1.2.0)
Recommends: gromacs
Suggests: gromacs-data
Breaks: gromacs-mpich (<< 2021.1-2), gromacs-openmpi (<< 2021.1-2)
Replaces: gromacs-mpich (<< 2021.1-2), gromacs-openmpi (<< 2021.1-2)
Filename: pool/universe/g/gromacs/gromacs-mpi_2021.4-2_amd64.deb
Size: 7240808
MD5sum: 7c70712b7645e5acf5de02982f86d087
SHA1: 45d7b39c61d419984ee3107604ee9cd0f5f70971
SHA256: 30a0f61b42c02bf7a87b97107f57100e4803172ec9a473f40397421f30fda1db
SHA512: 968d2282a3d3e073be438e538571cc78218ee8b8bcd8ed746cac66b76de07dd86fe2f498f86196f4e3a6cd11ca68b00295ee0adb0d6825e6d1bff8de4c8952db
Homepage: https://www.gromacs.org/
Description: Molecular dynamics sim, binaries for MPI parallelization
Description-md5: 691a95128c343600426f258bd96cc6ee