DeLano Scientific LLC
Email Support Services
> -Original Message-
> From: pymol-users-boun...@lists.sourceforge.net
> [mailto:pymol-users-boun...@lists.sourceforge.net] On Behalf
> Of Martin Höfling
> Sent: Friday, October 27, 2006 2:20 PM
> To: pymol-users@li
...got the svn code compiled with -D VMD...
If i load a PDB, then load a topology and then try to load a trajectory
via "load" loading the trajectory fails, complaining like this:
CmdLoad: "/home/martin/workspace/testdata/ProtOut.pdb" loaded as "ProtOut".
PyMOL>load /home/martin/workspace/testdat
To: Martin Höfling
> Cc: pymol-users@lists.sourceforge.net
> Subject: Re: [PyMOL] Support for gromacs trajectories and cube files
>
> Hi Martin,
>
> As far as I know there is no such plugin yet for gromacs trajectories.
> But you can convert the gromacs trajectory to a multim
Hi Martin,
As far as I know there is no such plugin yet for gromacs trajectories.
But you can convert the gromacs trajectory to a multimodel .pdb file
using gromacs utility trjconv and load that in pymol. Alternatively,
you could take up the effort of writing a plugin and have a look at
the way A
Hi everybody,
Does somebody of you know if gromacs trajectories (xtc or trr) are supported
by some plugin? Same thing with volumetric data in cube files?
I am using gromacs trajectories from python already by using the gromacs
c-libraries via ctypes. This is not truely platform independant or at
