Re: To all relax developers: presenting relax at the ENC conference and preliminary BMRB NMR-STAR file creation for model-free results. -- March 11, 2009 - 14:07

Oh, here is the CSA saveframe relax is currently producing:

save_chem_shift_anisotropy
   _Chem_shift_anisotropy.Sf_category Chem_shift_anisotropy
   _Chem_shift_anisotropy.ID 1
   _Chem_shift_anisotropy.Sample_condition_list_label $conditions_1
   _Chem_shift_anisotropy.Val_units ppm
   _CS_anisotropy_experiment.Sample_label $sample_1
   loop_
      _CS_anisotropy.ID
      _CS_anisotropy.Comp_index_ID
      _CS_anisotropy.Comp_ID
      _CS_anisotropy.Atom_ID
      _CS_anisotropy.Atom_isotope_number
      _CS_anisotropy.Val

1 9 Gln N 15 -160.0
2 9 Gln NE 15 -160.0
3 10 Gln N 15 -160.0
4 11 Leu N 15 -160.0

   stop_

save_


Regards,

Edward


On Wed, Mar 11, 2009 at 12:32 PM, Eldon Ulrich <elu@xxxxxxxxxxxxx> wrote:
> Hi,
>
> In the end all tags are data typed so the values can be stored appropriately
> in a relational database. Many tags end up with an enumeration list that can
> be either 'closed' (only the values in the list are acceptable) or 'open'
> (new values can be added when needed). Could you provide example values for
> the '.model_fit' tag and a specific definition?
>
> Thanks,
> Eldon