[gmx-users] Trajectory to .pdb

Peter Zoon zoon at science.uva.nl
Thu Apr 1 15:45:01 CEST 2004


You could do that with trjconv, and then export evry frame to pdb.
Keep in mind that the fileszie will increase dramatically !
If its only 1 structure it doesn't matter, but if you want to convert 
the whole trajectory I couldn't see why you would want to do that.

Cheers
Peter

>Dear Gromacs Users,
>I have the run the simulation of protein in water and now I want to
>convert the final trajectory file(.trr) to .pdb file. Please guide me how
>can I do that?
>
>Sincerely
>Ankur
>




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