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long.nex
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data_NUS_schedule_long_example ##################################################save_FID_sampling _FID_sampling.Sf_category FID_sampling _FID_sampling.NEX_format_version 0.7 _FID_sampling.File_generated_date 2019-07-08 _FID_sampling.ID 1 _FID_sampling.Software_ID 2 _FID_sampling.Software_name 'schedule generator' _FID_sampling.Experiment_name na _FID_sampling.NMR_spec_expt_ID 1 _FID_sampling.Layout_dimension_count 3 _FID_sampling.Layout_aux_dimension_count 1 _FID_sampling.Layout_hypercomplex_component_type full _FID_sampling.Layout_transient_type uniform 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 Ô_Schedule.Time_index_dim2Õ 2 time_multiplier 0.000010 na 2 time_offset 0 na 2 time_units sec na 2 quadrature_series_type lookup Ô_Schedule.Quadrature_index_dim2Õ 2 quadrature_multiplier 0 na 2 quadrature_offset 0 na 2 quadrature_units degree na 2 redfield_trick no na 2 details ? na 3 time_series_type linear Ô_Schedule.Time_index_dim3Õ 3 time_multiplier 0.000010 na 3 time_offset 0 na 3 time_units sec na 3 quadrature_series_type lookup Ô_Schedule.Quadrature_index_dim3Õ 3 quadrature_multiplier 0 na 3 quadrature_offset 0 na 3 quadrature_units degree na 3 redfield_trick no na 3 details na na AuxA series_type lookup Ô_Schedule.AuxA_indexÕ AuxA name tau na AuxA units sec na stop_ loop_ # This is the table that contains the NUS schedule _Schedule.FID_ID _Schedule.Proc_FID_ID _Schedule.Time_index_dim2 _Schedule.Quadrature_index_dim2 _Schedule.AuxA_index _Schedule.Time_index_dim3 _Schedule.Quadrature_index_dim3 _Schedule.Transient_count _Schedule.FID_weight _Schedule.Gap_schedule_dim1 1 1 0 0 0 0 0 16 1.0 gapScheduleA 2 2 1 1 1 1 90 16 1.0 gapScheduleB 3 3 2 0 2 2 0 16 1.0 gapScheduleA 4 4 3 1 3 3 90 16 1.0 gapScheduleB stop_ loop_ # The following loops provide information for tags that have # the type value set to ÔlookupÕ. _Quadrature_value_ordered_list.Dim2 _Quadrature_value_ordered_list.Dim3 ip echo ap anti-echo stop_ loop_ # Possible uses: relaxation study AuxA.Ordered_list 0.0 0.1 0.2 0.4 1.0 2.0 stop_ loop_ # used for NUS-like 1D burst sampling _Gap_schedule.Name _Gap_schedule.Ordinal _Gap_schedule.Time_point_start _Gap_schedule.Time_point_end gapScheduleA 1 255 300 gapScheduleA 2 511 580 gapScheduleA 3 1000 1060 gapScheduleA 4 1200 1250 gapScheduleA 5 1520 1590 gapScheduleB 1 300 360 gapScheduleB 2 512 590 gapScheduleB 3 1020 1110 gapScheduleB 4 1220 1355 gapScheduleB 5 1500 1575 stop_save_##################################################save_experiment_parameters # This save frame is used to capture information # specific to an experiment that uses the NUS # schedule defined above. _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Name HNCO _NMR_spec_expt.ID 1 loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details HNCO na na Ôlittle endianÕ 4 na na na na;Text field used to report additional information relevant to the specific experiment.; stop_ loop_ _Schedule_table_data_org.Param_ordinal _Schedule_table_data_org.Param_tag 1 Ô_Schedule.Time_index_dim2Õ 2 Ô_Schedule.Quadrature_index_dim2Õ 3 Ô_Schedule.AuxA_indexÕ 4 Ô_Schedule.Time_index_dim3Õ 5 Ô_Schedule.Quadrature_value_dim3Õ stop_ loop_ # Put values relevant to a specific experimental spectral instance # where the schedule is used in a separate loop. _Spectral_param.Dim _Spectral_param.Set_ID _Spectral_param.Parameter _Spectral_param.Value 1 1 size na 1 1 spectral_width_Hz 5000 1 1 obs_freq_MHz_at_center 500 1 1 obs_freq_at 0ppm 499.90 1 1 ppm_at_center 4.55 1 1 zero_order_phase_corr -50.0 1 1 first_order_phase_corr 0.0 1 1 nucleus 1H 1 1 label HN 1 1 details na 2 1 size na 2 1 spectral_width_Hz na 2 1 obs_freq_MHz_at_center na 2 1 obs_freq_at 0ppm na 2 1 ppm_at_center na 2 1 zero_order_phase_corr -50.0 2 1 first_order_phase_corr 0.0 2 1 nucleus 15N 2 1 label N 2 1 details na 3 1 size na 3 1 spectral_width_Hz na 3 1 obs_freq_MHz_at_center na 3 1 obs_freq_at 0ppm na 3 1 ppm_at_center na 3 1 zero_order_phase_corr -50.0 3 1 first_order_phase_corr 0.0 3 1 nucleus 13C 3 1 label CO 3 1 details na stop_save_save_sample_schedule_analysis _Sample_schedule_analysis.Sf_category sample_schedule_analysis _Sample_schedule_analysis.ID 1 _Sample_schedule_analysis.FID_sampling_ID 1 _Sample_schedule_analysis.Software_name ÕNEX converterÕ _Sample_schedule_analysis.Software_ID 1 loop_ _Schedule_analysis.Property _Schedule_analysis.Value 'FID_count' 20 'FID_coverage' 0.0617283950617 'Mean_evolution_time' 4.000000 'Max_increment' 9.000000 'PSR' na 'iSNR' na stop_ save_##################################################save_NEX_converter _Software.Sf_category software _Software.ID 1 _Software.Type 'schedule converter' _Software.Name 'NUS schedule converter' _Software.Version 0.7 _Software.DOI na _Software.Details ;Text field used to report additional information relevant to the software.; loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address 'John Example - NMRbox' 'Example' '[email protected]' stop_ loop_ _Task.Task 'Convert NUS schedules into NMR-STAR standardized format' stop_ save_##################################################save_schedule_generator _Software.Sf_category software _Software.ID 2 _Software.Type 'schedule generator' _Software.Name Õschedule generatorÕ _Software.Version na _Software.DOI na _Software.Details ;Text field used to report additional information relevant to the software.; loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address na na na stop_ loop_ _Task.Task na stop_ save_