[gmx-users] installion of gromacs 5.07

[Mark Abraham]

Hi,

Please consider installing a recent version of GROMACS, which is not only
easier to use and install but is still supported and will have fewer bugs,
too. Either way, you will need to use a more recent compiler than you seem
to have available on your system.

Mark

On Tue, Apr 17, 2018 at 11:47 AM SHAHEE ISLAM <islamshahee at gmail.com> wrote:

> hi,
> i am just new of gromacs.I want to install the gromacs 5.07.I am
> following this tutorial
> http://www.gromacs.org/Documentation/Installation_Instructions_5.0
>
> at first i have install cmake3.2.0.then follow this
> tar xfz gromacs-5.0.7.tar.gz
> cd gromacs-5.0.7
> mkdir build
> cd build
> cmake .. -DGMX_BUILD_OWN_FFTW=ON -DREGRESSIONTEST_DOWNLOAD=ON
> but atfer the last command i am getting this error
>
> -- No compatible CUDA toolkit found (v4.0+), disabling native GPU
> acceleration
> CMake Error at cmake/gmxTestSimd.cmake:100 (message):
>   Cannot find SSE4.1 compiler flag.  Use a newer compiler, or choose SSE2
>   SIMD (slower).
> Call Stack (most recent call first):
>   CMakeLists.txt:729 (gmx_test_simd)
>
>
> -- Configuring incomplete, errors occurred!
> See also "/data/gromacs/gromacs-5.0.7/build/CMakeFiles/CMakeOutput.log".
> See also "/data/gromacs/gromacs-5.0.7/build/CMakeFiles/CMakeError.log".
>
> How can i solve the problem and go for the further steps.Please help me.
> Thanking you
> shahee
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