GROMACS version:2020.5
GROMACS modification: Yes/No
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I am trying to remove pbc from trajectory files. I have tried several options discussed in gromacs forum. But not able to remove pbc. Please suggest me step to step procedure to remove pbc.
Hi,
Here you can find a workflow to fix periodicity effects Terminology — GROMACS 2021.3 documentation
Here some post in the forum that may help (maybe you saw them already or maybe not)
https://gromacs.bioexcel.eu/tag/gmx-trjconv
I hope it helps
Alessandra