[gmx-users] Replicate a structure

John Whittaker johnwhittake at zedat.fu-berlin.de
Tue Mar 10 13:30:40 CET 2020


Probably better to use gmx genconf; This situation is probably its main
purpose.

- John

> Gmx editconf you can use with -translate flag...after that merz the
> coordinates of two water droplets. I hope this may help you.
>
> On Tue 10 Mar, 2020, 9:35 AM Devargya Chakraborty, <
> devargyachakraborty.kgp at gmail.com> wrote:
>
>> I have an equilibrated droplet of water. What I want to do is replicate
>> that droplet in the x direction. So that my simulation box will carry
>> two
>> water droplets. Is that possible in gromacs. If yes please guide me.
>>
>> Thank you
>> Devargya Chakraborty
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