Hi,
I built an Argon box around my system that shall work as walls.
Therefore all Argon atoms should be frozen. There are 33900 Argon
atoms in my system but during grompp-ing the following message occurs:
Making dummy/rest group for T-Coupling containing 62956 elements
Making dummy/rest group for Acceleration containing 62956 elements
Making dummy/rest group for Freeze containing 29056 elements
WARNING 1 [file topol.top, line 33950]:
WARNING 2 [file topol.top, line 33950]:
(Yes the warning is empty). I found the following problem: Not all
atoms I put in my index group are frozen. Am I right, that there is a
maximum number of 29056 elements that can be put in a freeze group?
How can I circumvent that problem?
Cheers, Ilona
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