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FID Sampling
gryk edited this page Dec 26, 2018
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This save frame stores information about the software used to generate the sample schedule, the layout of the full set of experimental data collected, and specific data collection techniques used.
| Field | Schema | Necessity | Description |
|---|---|---|---|
| Sf_category | FID_sampling | Required | NMR-STAR Save Frame Category |
| ID | integer | Required | unique integer identifier |
| Software_ID | date | Optional | unique integer identifier Gryk notes. Is ID optional? |
| Software_name | string | Optional | common name of software Gryk notes. Name appears redundant to software save frame. |
| Experiment_name | string | Required | arbitrary name of experiment |
| NMR_spec_expt_ID | integer | Optional | experiment ID from spectrometer |
| Layout_dimension_count | positive integer | Required | number of dimensions |
| Layout_aux_dimension_count | positive integer | Optional | number of auxiliary dimensions |
| Layout_hypercomplex_component_type | enum | Required | full, partial ? |
| Layout_transient_type | enum | Required | uniform, non-uniform ? |
| Expt_quadrature_class | enum | Required | ? |
| Expt_redfield_trick | enum | Required | ? |
| FID_sampling_base | Loop | Required | table of key-value pairs for dimensions |
| Schedule | Loop | Required | table of fids in schedule |
| Gap_schedule | Loop | Optional | table of gap schedules for direct dimension |
This loop stores information about ...
| Field | Schema | Necessity | Description |
|---|---|---|---|
| Spectral_dim | ID | Required | ID for the spectral dimension |
| Parameter | enum | Required | One of the allowed parameters describing the spectral layout |
| Parameter_value | string | Required | value for the parameter |
| Param_tag | string | Required | arbitrary tag for the parameter |
This loop stores information about …
| Field | Schema | Necessity | Description |
|---|---|---|---|
| FID_ID | positive integer | Required | Unique Integer ID for each FID |
| Proc_FID_ID | positive integer | Optional | Unique Integer ID for ?? |
| Time_index_dimX | integer | Required | Time indel for dimensions. Multiply by FID_sampling_base->time_multiplier |
| Phase_index_dimX | integer | Required | Phase indel for dimensions. Multiply by FID_sampling_base->phasee_multiplier |
| AuxA_index | integer | Optional | Increment for Auxiliary axes |
| Transient_count | integer | Required | Number of repeated scans (transients) in this recorded FID |
| FID_weight | float | Required | Arbitrary weighting of FID |
| FID_sampling_ID | positive integer | Optional | For interleaved schedules, location of schedule |
| Gap_schedule_dim1 | Loop | Optional | Gap Schedule for direct dimension |
This loop stores information about data points in a FID with no data.
| Field | Schema | Necessity | Description |
|---|---|---|---|
| Name | string | Required | Arbitrary name |
| Ordinal | positive integer | sequence of bursts | |
| Time_point_start | positive integer | beginning of burst | |
| Time_point_end | positive integer | end of burst |
save_FID_sampling
_FID_sampling.Sf_category FID_sampling
_FID_sampling.ID 1
_FID_sampling.Software_ID 2
_FID_sampling.Software_name 'schedule generator'
_FID_sampling.Experiment_name HN-HSQC
_FID_sampling.Layout_dimension_count 2
_FID_sampling.Layout_hypercomplex_component_type full
_FID_sampling.Layout_transient_type uniform
_FID_sampling.Expt_quadrature_class na
_FID_sampling.Expt_redfield_trick no
loop_ # Keep schedule base parameters and values in one loop.
_FID_sampling_base.Spectral_dim
_FID_sampling_base.Parameter
_FID_sampling_base.Parameter_value
_FID_sampling_base.Param_tag
2 time_series_type linear ‘_Schedule.Time_index_dim2’
2 time_multiplier 0.000010 na
2 time_offset 0 na
2 time_units sec na
2 phase_series_type linear ‘_Schedule.Phase_index_dim2’
2 phase_multiplier 90 na
2 phase_offset 0 na
2 phase_units degree na
stop_
loop_
_Schedule.FID_ID
_Schedule.Time_index_dim2
_Schedule.Phase_index_dim2
_Schedule.Transient_count
_Schedule.FID_weight
1 0 0 16 1.0
2 0 1 16 1.0
stop_
save_