Re: Import BMRB dat to Relax -- January 14, 2013 - 10:32

Hi,

You seem to have sent this message twice:

http://thread.gmane.org/gmane.science.nmr.relax.user/1381
http://thread.gmane.org/gmane.science.nmr.relax.user/1382

Regards,

Edward



On 14 January 2013 01:55,  <mengjun.xue@xxxxxxxxxxxxxxxxxxxx> wrote:
> Dear Edward d'Auvergne,
>
> Since I just have one field strengh data now, which can not be calculated
> using dauvergne_protocol.py. The nmr data at second field will be got soon.
> Now I would like to try some demo data at 2 field strenghth in
> dauvergne_protocol.py
>
> I am trying one published relax data from BMRB. The data id in BMRB is
> 17226. I am trying to run the demo data in dauvergne_protocol.py.
>
> I am confused the parameter "sampleconditions" when loading the BMRB data,
> could you please tell me how to set the parameter "sampleconditions" when
> using bmrb.read(file=None, dir=None, version=None,
> sampleconditions=None) to load BMRB data in Relax?
>
> #######################
> #  Sample conditions  #
> #######################
>
> save_sample_conditions_1
>    _Sample_condition_list.Sf_category    sample_conditions
>    _Sample_condition_list.Sf_framecode   sample_conditions_1
>    _Sample_condition_list.Entry_ID       17226
>    _Sample_condition_list.ID             1
>    _Sample_condition_list.Details        .
>
> Here is the part of demo data 17226 about Sample conditions.
>
> Thank you very much.
>
> With best regards,
>
> Mengjun Xue