[gmx-users] Help

Mark Abraham mark.j.abraham at gmail.com
Mon Jul 16 10:14:13 CEST 2018


Hi,

I could see that you are installing GROMACS 2018. There is the more recent
patch release called GROMACS 2018.2, which you should prefer because it
fixes some issues while doing the same job as 2018.

Mark

On Wed, Jul 11, 2018 at 2:13 PM Maximiliano Sebastián Castillo <
mcastillo at itba.edu.ar> wrote:

> Sorry, but... what is BTW 2018.2? Another software?
>
> El mié., 11 jul. 2018 a las 6:50, Mark Abraham (<mark.j.abraham at gmail.com
> >)
> escribió:
>
> > Hi,
> >
> > I haven't seen that, and don't know how to guess what might make it work.
> > BTW 2018.2 is a better idea to install.
> >
> > Mark
> >
> > On Wed, Jul 11, 2018 at 3:34 AM Maximiliano Sebastián Castillo <
> > mcastillo at itba.edu.ar> wrote:
> >
> > > Hello,
> > > I have the next problem:
> > > [  1%] No patch step for 'fftwBuild'
> > > [  1%] No update step for 'fftwBuild'
> > > [  1%] Performing configure step for 'fftwBuild'
> > > checking for a BSD-compatible install... /usr/bin/install -c
> > > checking whether build environment is sane... configure: error: unsafe
> > > srcdir value: '/home/maximiliano/Proyecto
> > >
> Final/gromacs-2018/build/src/contrib/fftw/fftwBuild-prefix/src/fftwBuild'
> > > src/contrib/fftw/CMakeFiles/fftwBuild.dir/build.make:109: recipe for
> > target
> > >
> >
> 'src/contrib/fftw/fftwBuild-prefix/src/fftwBuild-stamp/fftwBuild-configure'
> > > failed
> > > make[2]: ***
> > >
> >
> [src/contrib/fftw/fftwBuild-prefix/src/fftwBuild-stamp/fftwBuild-configure]
> > > Error 1
> > > CMakeFiles/Makefile2:1440: recipe for target
> > > 'src/contrib/fftw/CMakeFiles/fftwBuild.dir/all' failed
> > > make[1]: *** [src/contrib/fftw/CMakeFiles/fftwBuild.dir/all] Error 2
> > > Makefile:162: recipe for target 'all' failed
> > > make: *** [all] Error 2
> > >
> > >
> > > What can I do for it?
> > > Thank you.
> > > Best regards.
> > > --
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