Just for completeness, there is actually an extra function for this:
(define *additional-solvent-ligands* '())
which can be added to the .coot file.
B
On 14/02/2013 17:10, Debreczeni, Judit wrote:
> Yes, it can be added to the .coot file like this:
>
> (append! *solvent-ligand-list* (list "TRS"))
>
> or like this for multiple molecules:
>
> (append! *solvent-ligand-list* (list "TRS" "XXX" "YYY"))
>
>
>
>
>>
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> -----Original Message-----
>> From: Mailing list for users of COOT Crystallographic Software
>> [mailto:[log in to unmask]] On Behalf Of Ulrich Gohlke
>> Sent: 14 February 2013 10:48
>> To: [log in to unmask]
>> Subject: [COOT] Add other solvent molecules setting
>>
>> Dear crystalleagues,
>>
>> in Extensions -> Modelling -> Add Other Solvent Molecules..., is there
>> a way to add common compounds such as TRS to the pre-selected molecules
>> permanently, i.e. one doesn't have to "Add a new Residue Type" every
>> time Coot is started? Can this be added to the .coot file or something?
>>
>> Cheers,
>>
>> Uli
>>
>> -----------------------------------------------------------------------
>> ----
>>
>> dr ulrich gohlke
>>
>> staff scientist - macromolecular structure and interaction
>>
>> max-delbrück-center for molecular medicine (mdc)
>>
>> +49 30 9406 - 2725 (w)
>>
>> +49 30 9406 - 2548 (fax)
>>
>> [log in to unmask]
>>
>> http://www.mdc-
>> berlin.de/en/research/research_teams/macromolecular_structure_and_inter
>> action/
--
***************************************************
Dr. Bernhard Lohkamp
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Div. Molecular Structural Biology
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