[gmx-users] (no subject)

[Erik Lindahl]

Anton Feenstra wrote:

>Justin Lorieau wrote:
>
>>Hi Anton,
>>
>>        The reason for my concern was because I observed significant unfolding at
>>the dimer interface when one of the subunits jumped over to the other end of
>>the box. If the interactions remain the same, then the unfolding I was
>>looking at was due to real unfolding.
>>
>
>The interactions are indeed supposed to be indifferent to PBC, 
>however  there was mention in the lists of some bugs related to 
>PBC, if I remember correctly it was in combintation with PME...
>
No, as you'll find on the list that bug only occurs for very skewed 
triclinic boxes and will cause a segmentation fault error,
so I'm pretty sure you are only seeing a perfectly normal translation!

Cheers,

Erik