[gmx-developers] Quick test after installation

Lod King lodking407 at gmail.com
Wed Jul 4 02:55:31 CEST 2018


Hi Gromacs friends

I installed Gromacs 2018.2 in my linux with the following steps,

$ tar xfz gromacs-2018.2.tar.gz

$ cd gromacs-2018.2/

$ mkdir build/

$ cd build

$ sudo apt install cmake

$ cmake .. -DGMX_BUILD_OWN_FFTW=ON -DREGRESSIONTEST_DOWNLOAD=ON

$ make

$ make check

$ sudo make install

$ source /usr/local/gromacs/bin/GMXRC


I wonder how I am going to run a quick test to see if my installation is
success?
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