Miguel Howard schrieb:

Egon,

We had some of this discussion a few months ago. Bits and pieces are
coming back to me.

The other disadvantage of 'replicating' the unitcell is that there will be
no bonding between cells.


Hi Miguel,
is there a protein PDB file which cuts a bond by the border of the asymmetric unit?
Regards, Jan


Q: Is there a solution to this problem?


don't cut bonds

Q: Within the file formats, is there a way to specify the bonding that
exists between cells?


the bounding box has not to be inside the unit cell


Miguel






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