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Irefine_ls_restr_type.distance_cutoff_high.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_ls_restr_type.distance_cutoff_highName:'_refine_ls_restr_type.distance_cutoff_high' Definition: The upper limit in angstroms of the distance range applied to the current restraint type. Type: float Mandatory item: no The permitted range is [0.0, infinity) Category: refine_ls_restr_type...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_ls_restr_type.distance_cutoff_high.html

Irefine_ls_restr_ncs.weight_position.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_ls_restr_ncs.weight_positionName:'_refine_ls_restr_ncs.weight_position' Definition: The value of the weighting coefficient used in noncrystallographic symmetry restraint of atom positions in the domain specified by _refine_ls_restr_ncs.dom_id to equivalent atom positions in the domains against which it ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_ls_restr_ncs.weight_position.html

Irefine_ls_restr_ncs.rms_dev_position.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_ls_restr_ncs.rms_dev_positionName:'_refine_ls_restr_ncs.rms_dev_position' Definition: The root-mean-square deviation in equivalent atom positions in the domain specified by _refine_ls_restr_ncs.dom_id and in the domains against which it was restrained. Type: float Mandatory item ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_ls_restr_ncs.rms_dev_position.html

Irefine_ls_restr_ncs.rms_dev_B_iso.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_ls_restr_ncs.rms_dev_B_isoName:'_refine_ls_restr_ncs.rms_dev_B_iso' Definition: The root-mean-square deviation in equivalent isotropic displacement parameters in the domain specified by _refine_ls_restr_ncs.dom_id and in the domains against which it was restrained. Type ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_ls_restr_ncs.rms_dev_B_iso.html

Irefine_ls_restr_ncs.dom_id.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_ls_restr_ncs.dom_idName:'_refine_ls_restr_ncs.dom_id' Definition: This data item is a pointer to _struct_ncs_dom.id in the STRUCT_NCS_DOM category. Type: code Mandatory item: yes Category: refine_ls_restr_ncs...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_ls_restr_ncs.dom_id.html

Irefine_ls_restr.rejects.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_ls_restr.rejectsName:'_refine_ls_restr.rejects' Definition: The number of parameters of this type that deviate from ideal values by more than the amount defined in _refine_ls_restr.criterion in the model obtained by restrained least-squares refinement. Type: int Mandatory item: no The permitted ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_ls_restr.rejects.html

Irefine_ls_restr.number.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_ls_restr.numberName:'_refine_ls_restr.number' Definition: The number of parameters of this type subjected to restraint in least-squares refinement. Type: int Mandatory item: no The permitted range is [0, infinity) Category: refine_ls_restr...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_ls_restr.number.html

Irefine_ls_restr.criterion.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_ls_restr.criterionName:'_refine_ls_restr.criterion' Definition: A criterion used to define a parameter value that deviates significantly from its ideal value in the model obtained by restrained least-squares refinement. Example: ' 3\s' Type: text Mandatory item: no Category: refine_ls_restr...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_ls_restr.criterion.html

Crefine_ls_class.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 Category REFINE_LS_CLASS Name: 'refine_ls_class' Description: Data items in the REFINE_LS_CLASS category record details about the reflections used for the structure refinement for each reflection class separately. Example: Example 1 - data for a modulated structure from van Smaalen [J. Phys. ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Crefine_ls_class.html

Irefine_hist.number_reflns_obs.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_hist.number_reflns_obsName:'_refine_hist.number_reflns_obs' Definition: The number of reflections that satisfy the resolution limits established by _refine_hist.d_res_high and _refine_hist.d_res_low and the observation criterion established by _reflns.observed_criterion. Type: int Mandatory item: no The permitted range ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_hist.number_reflns_obs.html

Irefine_hist.number_reflns_all.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_hist.number_reflns_allName:'_refine_hist.number_reflns_all' Definition: The number of reflections that satisfy the resolution limits established by _refine_hist.d_res_high and _refine_hist.d_res_low. Type: int Mandatory item: no The permitted range is [0, infinity) Category: refine_hist...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_hist.number_reflns_all.html

Irefine_hist.number_reflns_R_work.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_hist.number_reflns_R_workName:'_refine_hist.number_reflns_R_work' Definition: The number of reflections that satisfy the resolution limits established by _refine_hist.d_res_high and _refine_hist.d_res_low and the observation limit established by _reflns.observed_criterion, and that were used as the ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_hist.number_reflns_R_work.html

Irefine_hist.number_reflns_R_free.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_hist.number_reflns_R_freeName:'_refine_hist.number_reflns_R_free' Definition: The number of reflections that satisfy the resolution limits established by _refine_hist.d_res_high and _refine_hist.d_res_low and the observation limit established by _reflns.observed_criterion, and that were used as the ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_hist.number_reflns_R_free.html

Irefine_hist.number_atoms_total.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_hist.number_atoms_totalName:'_refine_hist.number_atoms_total' Definition: The total number of atoms that were included in the model at this cycle of the refinement. Type: int Mandatory item: no The permitted range is [0, infinity) Category: refine_hist...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_hist.number_atoms_total.html

Irefine_hist.number_atoms_solvent.html
Index Macromolecular dictionary (mmCIF) version 2.0.09 _refine_hist.number_atoms_solventName:'_refine_hist.number_atoms_solvent' Definition: The number of solvent atoms that were included in the model at this cycle of the refinement. Type: int Mandatory item: no The permitted range is [0, infinity) Category: refine_hist...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/cif_mm.dic/Irefine_hist.number_atoms_solvent.html


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