[gmx-users] Stopping protein jumping inside box
naga25sundar at gmail.com
Wed Feb 13 14:47:07 CET 2013
Plz try -pbc nojump option...It may work
On Wed, Feb 13, 2013 at 5:29 AM, 라지브간디 <rajiv at kaist.ac.kr> wrote:
> Dear gmx users,
> I need to stop my protein jumping inside box. I have used -pbc mol -ur
> compact -center command too but still the protein gets moving from one
> place to other.
> Could you please suggest me how to make the protein to stop in one place ?
> Moreover, its protein with their ligand.
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