[gmx-users] GROMACS 2018.x installation
gpoon at gsu.edu
Fri Aug 31 23:28:22 CEST 2018
I am having trouble installing gromacs-2018.x (x = 1 to 3) on Ubuntu
18.04. I invoked
cmake .. -DGMX_BUILD_OWN_FFTW=ON -DREGRESSIONTEST_DOWNLOAD=ON -DGMX_GPU=on
on a simple i7-7700 machine with a GTX-970 GPU. In both cases,
everything went until make check, at which point a series of errors on
failed tests were thrown (linked). I confirmed that CUDA 9.2 was
installed via nvidia-smi, but the same errors (as far as I could tell)
occurred even without the -DGMX_GPU flag, suggesting that it was not
GPU-related. My GCC version 7.3.
I had looked through previous posts about difficulty with gromacs-2018.x
installation butdid not find an obvious connection.
Thanks in advance for going through the log and your insights.
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