[gmx-users] GPU installation of gromacs:Tesla K20c
scinikhil at gmail.com
Fri Oct 9 07:49:33 CEST 2015
i have Tesla K20 GPU and ubuntu 15.04 and i installed cuda 7.5.after that i
executed the following commands
tar xfz gromacs-5.0.5.tar.gz
cmake .. -DGMX_BUILD_OWN_FFTW=ON -DREGRESSIONTEST_DOWNLOAD=ON
sudo make install
everything is completed without any error
what i have to do next for gromacs installation in linux
i seen the files of gromacs in usr/local/gromacs/share/gromacs
but when i give mdrun or pdb2gmx it asking for install gromacs
sudo apt-get install gromacs?
what i have to do next to get a working gromacs in gpu?
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