Thanks Mark...
Pada tanggal 9 Jun 2016 18.58, "Mark Abraham"
menulis:
> Hi,
>
> Please use a released version of GROMACS and don't smash your OS by running
> make with sudo. Then we can consider problems that may arise :-)
>
> Mark
>
> On Thu, 9 Jun 2016 11:30 Andrian
Hi,
Please use a released version of GROMACS and don't smash your OS by running
make with sudo. Then we can consider problems that may arise :-)
Mark
On Thu, 9 Jun 2016 11:30 Andrian Saputra wrote:
> Hi..May be its not a gromacs master..
> But i think there is no
Hi..May be its not a gromacs master..
But i think there is no problem with source
Pada tanggal 9 Jun 2016 15.48, "Kutzner, Carsten" menulis:
>
> > On 09 Jun 2016, at 09:33, Andrian Saputra
> wrote:
> >
> > Hi,,
> >
> > Ya i hve tried to install version
> On 09 Jun 2016, at 09:33, Andrian Saputra wrote:
>
> Hi,,
>
> Ya i hve tried to install version 5.0 and all compilation is ok... but i
> familiar with version 4.5, 4.6... version 5.0 need some changes in mdp
> file...
But isn't this the master version of GROMACS that
Hi,,
Ya i hve tried to install version 5.0 and all compilation is ok... but i
familiar with version 4.5, 4.6... version 5.0 need some changes in mdp
file...
Do you have idea about the error ??
Thank you
Pada tanggal 9 Jun 2016 14.16, "Kutzner, Carsten" menulis:
> Hi,
>
> the
Hi,
the error message you see has nothing to do with IMD. Have you tried
to install a Gromacs 5.0 or 5.1 or 2016 version? These should all
work out of the box with IMD.
Best,
Carsten
> On 09 Jun 2016, at 04:35, Andrian Saputra wrote:
>
> Dear gromacs users
>
> i
Dear gromacs users
i was trying to install gromacs-imd that was developed by Martin Hoefling
http://www.mpibpc.mpg.de/grubmueller/interactivemd
all configuration is ok with this command:
CC=$HOME/software/openmpi/bin/mpicc
CXX=$HOME/software/openmpi/bin/mpicxx