[gmx-developers] center of mass bug with pulling reference group

[Jochen Hub]

>>
>> Thanks a lot Berk,
>>
>> Jochen
>>
>>     
> In x-y it should not matter.
> But what might matter is that distances of atoms in the bilayer to the
> pbc atom are larger
> than half the box length, if the pbc atom is in a head group instead of
> in the middle of the bilayer.
>   
Aaahh, not again the bloody pbc_atom... :(( Arrrg, I had this problem 
already 2 years ago, but I forgot, hmpf.  We fixed the script and now 
things are all right. So all my apologies for waisting your time. :) And 
thanks a lot for your help!

Best wishes,

Jochen



> Berk
>
>   


-- 
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Dr. Jochen Hub
Molecular Biophysics group
Dept. of Cell & Molecular Biology
Uppsala University. Box 596, 75124 Uppsala, Sweden.
Phone: +46-18-4714451 Fax: +46-18-511755
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