GROMACS 2016 can be now installed using yum command on CentOS or other OS.
Use command yum to find the available packages of GROMACS.
sudo yum list gromacs*The output is
Available Packagesgromacs.x86_64 2016.4-1.el7 epelgromacs-common.noarch 2016.4-1.el7 epelgromacs-devel.x86_64 2016.4-1.el7 epelgromacs-doc.noarch 2016.4-1.el7 epelgromacs-libs.x86_64 2016.4-1.el7 epelgromacs-mpich.x86_64 2016.4-1.el7 epelgromacs-openmpi.x86_64 2016.4-1.el7 epelThen we choose the first one, gromacs.x86_64. Type the following command for installing.
sudo yum install gromacs.x86_64Wait for a while.
Below is name list of dependency packages that GROMACS needs.
Installing: gromacs x86_64 2016.4-1.el7 epel 215 kInstalling for dependencies: fftw-libs-double x86_64 3.3.3-8.el7 base 759 k fftw-libs-single x86_64 3.3.3-8.el7 base 766 k gromacs-common noarch 2016.4-1.el7 epel 793 k gromacs-libs x86_64 2016.4-1.el7 epel 11 M libICE x86_64 1.0.9-9.el7 base 66 k libSM x86_64 1.2.2-2.el7 base 39 k lmfit x86_64 6.1-3.el7 epel 20 k tng x86_64 1.8.2-1.el7 epel 128 kWhen the installation is completed, you can run GROMACS using gmx command.
Rangsiman