[gmx-users] LINCS

Neda Rafiee nerafiee at ipm.ir
Sun Apr 9 13:38:21 CEST 2017


Thanks....

----- Original Message -----
From: "João Henriques" <joao.m.a.henriques at gmail.com>
To: gmx-users at gromacs.org
Sent: Sunday, April 9, 2017 3:37:46 PM
Subject: Re: [gmx-users] LINCS

Google is your friend, *always*.

Please see the last section on:

http://www.gromacs.org/Documentation/Errors

/J

On Sun, Apr 9, 2017 at 10:00 AM, Neda Rafiee <nerafiee at ipm.ir> wrote:

> Dear gmx-users,
> I have a problem in doing nv pequilibration for my pritein-water system, I
> do not understand the error:
> There is no domain decomposition for 16 ranks that is compatible with the
> given box and a minimu$
> Change the number of ranks or mdrun option -rcon or -dds or your LINCS
> settings
> Look in the log file for details on the domain decomposition
>
>
>
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