PDBx/mmCIF
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Data Item
_computing.structure_refinement
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Supporting Data
General
Item name
_computing.structure_refinement
Category name
computing
Attribute name
structure_refinement
Required in PDB entries
no
Used in currrent PDB entries
No
Item Description
Software used for refinement of the structure. Give the program or package name and a brief reference.
Item Examples
2
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Item Example1
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SHELX85 (Sheldrick, 1985)
Item Example2
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X-PLOR (Brunger, 1992)
Data Type
Data type code
text
Data type detail
text item types / multi-line text ...
Primitive data type code
char
Regular expression
[][ \n\t()_,.;:"&<>/\{}'`~!@#$%?+=*A-Za-z0-9|^-]*
Controlled Vocabulary at Deposition
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Allowed Value
Details
CNS
CORELS
GPRLSA
JACK-LEVITT
NUCLSQ
PHENIX
PROFFT
PROLSQ
REFMAC
RESTRAIN
SHELXL
TNT
X-PLOR
XTALVIEW
Related Items
Related Item Name
Relation Type
_software.name
replacedby
_software.classification
replacedby
Aliases
Alias Item Name
Dictionary Name
Dictionary Version
_computing_structure_refinement
cif_core.dic
2.0.1