[gmx-users] conversion of Gromacs trajectories (rhombic dodecahedric), and topologies to Amber format

Albert mailmd2011 at gmail.com
Mon Jan 21 11:32:26 CET 2013


probably you can try "catdcd"


On 01/21/2013 11:29 AM, Anna Marabotti wrote:
> Dear gmx-users,
> I followed the suggestions by Justin and Daniel to convert the 
> trajectories, but still Amber does not recognize the correct format 
> and complains about the fact that it does not find the correct box 
> dimensions.
> It seems that the two tools are quite incompatible, especially when 
> the trajectory is not in the classic cubic format.
> This is just for records since it is a recurrent query in the gmx-user 
> archive, still apparently with no solution.
> Many thanks in any case and best regards
> Anna




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