From: Giacomo Fiorin (
Date: Wed Dec 05 2018 - 13:51:42 CST

Please look at the lines before and after that one, and take a look at the
following section:

That line is OK only if the constraint error tolerance is appropriate for
your system. It is always a good idea to be aware of the parameters that
you put in, especially those that are not default.


On Wed, Dec 5, 2018 at 2:35 PM L- <> wrote:

> i am ruining simulation in water box for protein , I found one line in
> the log file ,, that say "Info: ERROR TOLERANCE : 1e-05"
> it is only in one line .. and the simulation run ok with no FATAL ERROR unit
> it done ..
> is that line ok , or i should change something
> thank you .
> Lamya

Giacomo Fiorin
Associate Professor of Research, Temple University, Philadelphia, PA
Contractor, National Institutes of Health, Bethesda, MD

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