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Iitem_examples.case.html: Index DDL dictionary version 2.1.3 _item_examples.caseName:'_item_examples.case' Definition: An example application of the defined data item. Type: text Mandatory item: no Category: item_examples...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/2/ddl_core/Iitem_examples.case.html

Cphasing_MIR_der_shell.html: Index Macromolecular dictionary (mmCIF) version 2.0.09 Category PHASING_MIR_DER_SHELL Name: 'phasing_MIR_der_shell' Description: Data items in the PHASING_MIR_DER_SHELL category record statistics, broken down into shells of resolution, for an MIR phasing experiment. This list may contain information from a number of different derivatives; _phasing ... ...

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

Cphasing_MIR_der.html: Index Macromolecular dictionary (mmCIF) version 2.0.09 Category PHASING_MIR_DER Name: 'phasing_MIR_der' Description: Data items in the PHASING_MIR_DER category record details about individual derivatives used in the phasing of the structure when methods involving isomorphous replacement are involved. A derivative in this context does not necessarily equate ... ...

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

Cphasing_MIR.html: Index Macromolecular dictionary (mmCIF) version 2.0.09 Category PHASING_MIR Name: 'phasing_MIR' Description: Data items in the PHASING_MIR category record details about the phasing of the structure where methods involving isomorphous replacement are involved. All isomorphous-replacement-based techniques are covered by this category, including single isomorphous replacement (SIR), multiple ... ...

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

Creflns_class.html: Index Core dictionary (coreCIF) version 2.4.5 Category REFLNS_CLASS Name: '_reflns_class_[]' Definition: Data items in the REFLNS_CLASS category record details, for each reflection class, about the reflections used to determine the structural parameters. Example: Example 1 - corresponding to the one-dimensional incommensurately modulated structure of K~2~SeO~4 ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Creflns_class.html

Cdiffrn_reflns_class.html: Index Core dictionary (coreCIF) version 2.4.5 Category DIFFRN_REFLNS_CLASS Name: '_diffrn_reflns_class_[]' Definition: Data items in the DIFFRN_REFLNS_CLASS category record details about the classes of reflections measured in the diffraction experiment. Example: Example 1 - example corresponding to the one-dimensional incommensurately modulated structure of K~2~SeO ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Cdiffrn_reflns_class.html

Ichemical_absolute_configuration.html: Index Core dictionary (coreCIF) version 2.4.5 _chemical_absolute_configuration Name: '_chemical_absolute_configuration' Definition: Necessary conditions for the assignment of _chemical_absolute_configuration are given by H. D. Flack and G. Bernardinelli (1999, 2000). Ref: Flack, H. D. & Bernardinelli, G. (1999). Acta Cryst. A55, 908-915. (http://www.iucr.org/paper ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Ichemical_absolute_configuration.html

Idiffrn_measured_fraction_theta_full.html: Index Core dictionary (coreCIF) version 2.4.5 _diffrn_measured_fraction_theta_full Name: '_diffrn_measured_fraction_theta_full' Definition: Fraction of unique (symmetry-independent) reflections measured out to _diffrn_reflns_theta_full. The permitted range is 0 -> 1.0 Type: numb Category: diffrn...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Idiffrn_measured_fraction_theta_full.html

Idiffrn_measured_fraction_theta_max.html: Index Core dictionary (coreCIF) version 2.4.5 _diffrn_measured_fraction_theta_max Name: '_diffrn_measured_fraction_theta_max' Definition: Fraction of unique (symmetry-independent) reflections measured out to _diffrn_reflns_theta_max. The permitted range is 0 -> 1.0 Type: numb Category: diffrn...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Idiffrn_measured_fraction_theta_max.html

Idiffrn_detector_area_resol_mean.html: Index Core dictionary (coreCIF) version 2.4.5 _diffrn_detector_area_resol_mean Name: '_diffrn_detector_area_resol_mean' Definition: The resolution of an area detector, in pixels/mm. The permitted range is 0.0 -> infinity Type: numb Category: diffrn_detector...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Idiffrn_detector_area_resol_mean.html

Icell_reciprocal_angle_.html: Index Core dictionary (coreCIF) version 2.4.5 _cell_reciprocal_angle_ Names: '_cell_reciprocal_angle_alpha' '_cell_reciprocal_angle_beta' '_cell_reciprocal_angle_gamma' Definition: The angles defining the reciprocal cell in degrees. These are related to those in the real cell by: cos(recip-alpha) = [cos(beta)*cos(gamma) - cos(alpha)]/[sin ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Icell_reciprocal_angle_.html

Icell_reciprocal_length_.html: Index Core dictionary (coreCIF) version 2.4.5 _cell_reciprocal_length_ Names: '_cell_reciprocal_length_a' '_cell_reciprocal_length_b' '_cell_reciprocal_length_c' Definition: The reciprocal-cell lengths in inverse angstroms. These are related to the real cell by: recip-a = b*c*sin(alpha)/V recip-b = c*a*sin(beta ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Icell_reciprocal_length_.html

Iatom_site_refinement_flags_posn.html: Index Core dictionary (coreCIF) version 2.4.5 _atom_site_refinement_flags_posn Name: '_atom_site_refinement_flags_posn' Definition: A code which indicates the refinement restraints or constraints applied to the positional coordinates of this site. Appears in list containing _atom_site_label Related item: _atom_site_refinement_flags (alternate) The data ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Iatom_site_refinement_flags_posn.html

Iatom_site_refinement_flags_occupancy.html: Index Core dictionary (coreCIF) version 2.4.5 _atom_site_refinement_flags_occupancy Name: '_atom_site_refinement_flags_occupancy' Definition: A code which indicates that refinement restraints or constraints were applied to the occupancy of this site. Appears in list containing _atom_site_label Related item: _atom_site_refinement_flags (alternate) The data ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Iatom_site_refinement_flags_occupancy.html

Iatom_site_refinement_flags_adp.html: Index Core dictionary (coreCIF) version 2.4.5 _atom_site_refinement_flags_adp Name: '_atom_site_refinement_flags_adp' Definition: A code which indicates the refinement restraints or constraints applied to the atomic displacement parameters of this site. Appears in list containing _atom_site_label Related item: _atom_site_refinement_flags (alternate) The ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Iatom_site_refinement_flags_adp.html

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