[gmx-users] Installation

Alex alexanderwien2k at gmail.com
Sun Apr 1 02:07:51 CEST 2018


Dear all,

I am trying to install gromacs2018.1 locally in a cluster, I have already
installed again locally the openmpi-2.1.1 and gcc-4.9.4, and even invoking
the
~mpicc --version (or gcc --version) gives gcc (GCC) 4.9.4 which is what I
have installed and fine, but when I invoke

~ cmake .. -DGMX_MPI=ON -DGMX_FFT_LIBRARY=mkl -DREGRESSIONTEST_PATH=ON
-DCMAKE_INSTALL_PREFIX=/home/alex54/.local/gromacs-2018.1

it starts with these line:
-- The C compiler identification is GNU 4.4.7
-- The CXX compiler identification is GNU 4.4.7
.....

And then failed with below error
CMake Error at cmake/gmxTestCXX11.cmake:135 (message):
  GROMACS requires version 4.8.1 or later of the GNU C++ compiler for.

Complaining about the 4.8.1 version of gcc, but I have already a newer
version.

I have also the camke in version 3.11.0 in my machine.

Any help would be highly appreciated.

Regards,
Alex


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