[gmx-users] Can gromacs handle reflective boundary condition ?

Mark Abraham Mark.Abraham at anu.edu.au
Wed Apr 11 04:40:10 CEST 2012


On 10/04/2012 11:50 PM, stjohn55 wrote:
> Dear,
>       Can gromacs handle reflective boundary condition, in order to 
> remove the periodicity of Z-axis ?

No.

Mark

>       Do I need to take advantage of walls and Ewald ?
>       Thanks so much!
>                                                                       
>                                     Yours,  John Yu
>                                                                       
>                                        2012.04.10
>
>

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