[gmx-users] Fwd: Static compilation of gromacs

[Alexey Shvetsov]

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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