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Redefine some of the key items as Related #627

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Merged
jamesrhester merged 1 commit into from
Jul 13, 2026
+18 −18
Merged

Redefine some of the key items as Related #627

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36 changes: 18 additions & 18 deletions cif_core.dic
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Original file line number Diff line number Diff line change
Expand Up @@ -11,7 +11,7 @@ data_CIF_CORE
_dictionary.title CIF_CORE
_dictionary.class Instance
_dictionary.version 3.3.0
_dictionary.date 2026-07-01
_dictionary.date 2026-07-10
_dictionary.uri
https://raw.githubusercontent.com/COMCIFS/cif_core/master/cif_core.dic
_dictionary.ddl_conformance 4.2.0
Expand Down Expand Up @@ -10228,15 +10228,15 @@ save_
save_chemical_conn_bond.id

_definition.id '_chemical_conn_bond.id'
_definition.update 2023-02-02
_definition.update 2026-07-10
_description.text
;
Unique identifier for the bond.
;
_name.category_id chemical_conn_bond
_name.object_id id
_type.purpose Key
_type.source Derived
_type.source Related
_type.container Single
_type.contents Word

Expand Down Expand Up @@ -13333,15 +13333,15 @@ save_
save_geom_angle.id

_definition.id '_geom_angle.id'
_definition.update 2023-02-02
_definition.update 2026-07-10
_description.text
;
An arbitrary, unique identifier for the angle formed by the three atoms.
;
_name.category_id geom_angle
_name.object_id id
_type.purpose Key
_type.source Derived
_type.source Related
_type.container Single
_type.contents Word

Expand Down Expand Up @@ -13620,15 +13620,15 @@ save_
save_geom_bond.id

_definition.id '_geom_bond.id'
_definition.update 2023-02-02
_definition.update 2026-07-10
_description.text
;
Unique identifier for the bond.
;
_name.category_id geom_bond
_name.object_id id
_type.purpose Key
_type.source Derived
_type.source Related
_type.container Single
_type.contents Word

Expand Down Expand Up @@ -13912,15 +13912,15 @@ save_
save_geom_contact.id

_definition.id '_geom_contact.id'
_definition.update 2023-02-02
_definition.update 2026-07-10
_description.text
;
An identifier for the contact that is unique within the loop.
;
_name.category_id geom_contact
_name.object_id id
_type.purpose Key
_type.source Derived
_type.source Related
_type.container Single
_type.contents Word

Expand Down Expand Up @@ -14303,15 +14303,15 @@ save_
save_geom_hbond.id

_definition.id '_geom_hbond.id'
_definition.update 2023-02-02
_definition.update 2026-07-10
_description.text
;
An identifier for the hydrogen bond that is unique within the loop.
;
_name.category_id geom_hbond
_name.object_id id
_type.purpose Key
_type.source Derived
_type.source Related
_type.container Single
_type.contents Word

Expand Down Expand Up @@ -14627,15 +14627,15 @@ save_
save_geom_torsion.id

_definition.id '_geom_torsion.id'
_definition.update 2023-02-02
_definition.update 2026-07-10
_description.text
;
An identifier for the torsion angle that is unique within its loop.
;
_name.category_id geom_torsion
_name.object_id id
_type.purpose Key
_type.source Derived
_type.source Related
_type.container Single
_type.contents Word

Expand Down Expand Up @@ -15074,15 +15074,15 @@ save_
save_model_site.id

_definition.id '_model_site.id'
_definition.update 2023-02-02
_definition.update 2026-07-10
_description.text
;
An identifier for the model site that is unique within its loop.
;
_name.category_id model_site
_name.object_id id
_type.purpose Key
_type.source Derived
_type.source Related
_type.container Single
_type.contents Word

Expand Down Expand Up @@ -18330,15 +18330,15 @@ save_
save_database_related.id

_definition.id '_database_related.id'
_definition.update 2023-02-02
_definition.update 2026-07-10
_description.text
;
An identifier for this database reference.
;
_name.category_id database_related
_name.object_id id
_type.purpose Key
_type.source Recorded
_type.source Related
_type.container Single
_type.contents Word

Expand Down Expand Up @@ -29384,7 +29384,7 @@ save_
Changed the purpose of the _diffrn_radiation_wavelength.id data item
from 'Encode' to 'Key'.
;
3.3.0 2026-07-01
3.3.0 2026-07-10
;
Expanded available form factor parameterisations, added support for
isotopes and symmforms for atom sites. More details can be added
Expand Down