VMD-L Mailing List
From: Peter Freddolino (petefred_at_ks.uiuc.edu)
Date: Sun Dec 21 2008 - 21:30:56 CST
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Have a look at pbctools
(http://www.ks.uiuc.edu/Research/vmd/plugins/pbctools/), but be sure to
heed the warning that comes with unwrapping trajectories.
That being said (and I'm a big vmd fan ;-), you should also be able to
do this with trjconv as well, believe.
Best,
Peter
Alessandro.Maiorana_at_roma2.infn.it wrote:
> Hi all,
>
> I have a Gromacs' trajectory (.trr). I would like to remove the PBC. What
> can I do? Thanks for the help. Bye
>
> Alessandro Maiorana
>
- Next message: John Stone: "Re: How to get all the angle combinations?"
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- In reply to: Alessandro.Maiorana_at_roma2.infn.it: "Remove PBC"
- Next in thread: Taufik Al-Sarraj: "measure the distance between center of molecules"
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