[gmx-users] 10-4-3 implicit wall potential

Berk Hess gmx3 at hotmail.com
Tue Jan 5 15:09:46 CET 2010


Why not use the tabulated wall potential?
That does not require are changes to the code.


> Date: Tue, 5 Jan 2010 14:13:30 +0100
> From: qiaobf at gmail.com
> To: gmx-users at gromacs.org
> Subject: [gmx-users] 10-4-3 implicit wall potential
> HI all,
> Does anyone have experience to implement the 10-4-3 implicit wall
> potential?  If I want to use it, which files do I need to change, except
> wall.c? Can anyone give some suggestions?
> Thanks a lot!
> best wishes,
> Baofu Qiao
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