Hi, Try gmx [command] . Ex. gmx mdrun -option
Regards, Husen > On 21 Apr 2016, at 12.31, terrence...@gmail.com wrote: > > Hi, > > Try gmx_mpi. > > Regards > Terry > > >> On 21 Apr 2016, at 12:11 PM, Md. Imrul Reza Shishir >> <imrul.reza.shis...@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* >> -- >> Gromacs Users mailing list >> >> * Please search the archive at >> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! >> >> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists >> >> * For (un)subscribe requests visit >> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a >> mail to gmx-users-requ...@gromacs.org. > -- > Gromacs Users mailing list > > * Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! > > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > > * For (un)subscribe requests visit > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a > mail to gmx-users-requ...@gromacs.org. -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.