[gmx-users] Installation Problem... No command 'gmx' found

[Email Gmail Pribadi]

Hi,

Try gmx [command] . Ex. gmx mdrun -option

Regards,


Husen

> On 21 Apr 2016, at 12.31, terrencesun at gmail.com wrote:
> 
> Hi, 
> 
> Try gmx_mpi.
> 
> Regards
> Terry
> 
> 
>> On 21 Apr 2016, at 12:11 PM, Md. Imrul Reza Shishir <imrul.reza.shishir at gmail.com> wrote:
>> 
>> Dear all user
>> 
>> I install gromacs in my laptop its perfectly ok. But i have problem to
>> install in my desktop there i face problem.
>> In my desktop i want to compile with cuda accelerator and MPI option. I
>> install successfully openmpi-1.10.2 and cuda-7.5 with nvidia driver. all
>> this driver is ok.
>> 
>> For gromacs i run this installation command.
>> 
>> tar -xzvf gromacs-5.1.2.tar.gz
>> cd gromacs-5.1.2.tar.gz
>> mkdir build
>> cd build
>> CMAKE <gromacs-5.1.2 file location > -DGMX_BUILD_OWN_FFTW=on -DGMX_GPU=on
>> -DGMX_MPI=on -DREGRESSIONTEST_DOWNLOAD=on
>> make -j16
>> make check
>> sudo make install -j16
>> 
>> source /usr/local/gromacs/bin/GMXRC
>> 
>> In the installation procedure i dont find any error. All 26 test completed
>> without error.
>> 
>> But when i try to run "gmx or gmx help"
>> 
>> There is error no command gmx found. I need your guidance.
>> 
>> Best Regards
>> 
>> -- 
>> *Md Imrul Reza Shishir*
>> -- 
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