[gmx-users] Inconsistent Shifts
imanahmadabadi75 at gmail.com
Sun Feb 25 10:34:20 CET 2018
I have tried the 2016.5 version of gromacs that it has the same warning
about the inconsistent shifts. I don't know why it should arises as a
warning and what is the problem. Is there another way to fix this warning?
On Wed, Feb 21, 2018 at 11:26 AM, Iman Ahmadabadi <
imanahmadabadi75 at gmail.com> wrote:
> Dear Dallas,
> Yes, the system has periodic molecules (periodic-molecules = yes) and the
> version of gromacs is 5.1.2. So, I should use for calculating the
> properties of the system by gromacs 2016 and newer ones?
> On Tue, Feb 20, 2018 at 2:57 PM, Iman Ahmadabadi <
> imanahmadabadi75 at gmail.com> wrote:
>> Dear Gromacs users,
>> In using some commands in gromacs, the sentence "There were 240
>> inconsistent shifts. Check your topology" come up on the screen and I don't
>> know what is wrong in my topology file, however it calculates correctly the
>> features of the system but I would like to know the reason of this warning.
More information about the gromacs.org_gmx-users