On 27/01/12 09:45, [email protected] wrote:
Does this also update the cif dictionary, or stays the change inside
coot?
It stays within Coot. It does not update the cif dictionary - IMHO, that
would be a Bad Thing - maybe you are just experimenting.
It creates new set of restraints under a new name (comp-id) and renames
the residue accordingly [1].
You can write out the new restraints: Edit -> Restraints -> Save as
mmCIF...
Paul.
[1] Incidentally, some of us developers would like wwPDB to reserve a
set of comp-ids so that we can do this safely without bumping into
comp-ids for which a dictionary already exists.
