XmlmmCIF equivalent: computing
Data items in the COMPUTING category record details about the
computer programs used in the crystal structure analysis.
Data items in this category would not, in general, be used in
a macromolecular CIF. The category SOFTWARE, which allows
for a more detailed description of computer programs and
their attribues, would be used instead.
XmlmmCIF equivalent: computing/cell_refinement
Software used in refining the cell.
Give the program or package name and a brief reference.
XmlmmCIF equivalent: computing/data_collection
Software used for data collection.
Give the program or package name and a brief reference.
XmlmmCIF equivalent: computing/data_reduction
Software used for data reduction.
Give the program or package name and a brief reference.
XmlmmCIF equivalent: computing/molecular_graphics
Software used for molecular graphics.
Give the program or package name and a brief reference.
XmlmmCIF equivalent: computing/pdbx_data_reduction_ds
Program/package name for data reduction/data scaling
XmlmmCIF equivalent: computing/pdbx_data_reduction_ii
Program/package name for data reduction/intensity integration software
XmlmmCIF equivalent: computing/pdbx_structure_refinement_method
Program/package name for structure refinement method.
XmlmmCIF equivalent: computing/publication_material
Software used for generating material for publication.
Give the program or package name and a brief reference.
XmlmmCIF equivalent: computing/structure_refinement
Software used for refinement of the structure.
Give the program or package name and a brief reference.
XmlmmCIF equivalent: computing/structure_solution
Software used for solution of the structure.
Give the program or package name and a brief reference.
XmlmmCIF equivalent: computing/entry_id
This data item is a pointer to _entry.id in the ENTRY category.