[gmx-users] Fwd: Static compilation of gromacs

Alexey Shvetsov alexxy at omrb.pnpi.spb.ru
Tue May 14 22:46:27 CEST 2013

В письме от 15 мая 2013 00:11:49 пользователь Андрей Гончар написал:
> Hi. I'm trying to static compile gromacs from source, everything goes well,
> but when I
> move it to another machine and try to launch mdrun I got a message:
> mdrun: error while loading shared libraries: libfftw3f.so.3: cannot open
> shared object file: No such file or directory
> I run ./configure with the following options:
> ./configure --prefix=$PREF --enable-all-static --with-x=no --enable-mpi
> --without-xml --disable-shared --with-fft=fftw3
> The goal is to compile gromacs on one computer and to use it on another. I
> haven't root privileges on another machine so I decided to make a
> statically linked instance of gromacs, copy it to another computer and use
> it from my home directory.

You dont need root privileges to install gromacs for example in ${HOME}/usr
also its good idea to build gromacs on target machine
Best Regards,
Alexey 'Alexxy' Shvetsov
Petersburg Nuclear Physics Institute, NRC Kurchatov Institute, 
Gatchina, Russia
Department of Molecular and Radiation Biophysics
Gentoo Team Ru
Gentoo Linux Dev
mailto:alexxyum at gmail.com
mailto:alexxy at gentoo.org
mailto:alexxy at omrb.pnpi.spb.ru
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