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 Results for DC.creator="P." AND DC.creator="E." AND DC.creator="Bourne" in section 3.6.6 of volume G   page 1 of 2 pages.
Analysis
Fitzgerald, P. M. D., Westbrook, J. D., Bourne, P. E., McMahon, B., Watenpaugh, K. D. and Berman, H. M.  International Tables for Crystallography (2006). Vol. G, Section 3.6.6, pp. 152-164 [ doi:10.1107/97809553602060000738 ]
... MAD_CLUST (c) PHASING_MAD_EXPT (d) PHASING_MAD_RATIO (e) PHASING_MAD_SET The bullet () indicates a category key. Where ... SHELL (c) PHASING_MIR_DER (d) PHASING_MIR_DER_REFLN (e) PHASING_MIR_DER_SHELL (f) PHASING_MIR_DER_SITE The ... NCS (c) REFINE_LS_RESTR_TYPE (d) REFINE_LS_SHELL (e) REFINE_LS_CLASS The bullet () indicates a category key. ...

Individual reflections
Fitzgerald, P. M. D., Westbrook, J. D., Bourne, P. E., McMahon, B., Watenpaugh, K. D. and Berman, H. M.  International Tables for Crystallography (2006). Vol. G, Section 3.6.6.3.1, pp. 162-163 [ doi:10.1107/97809553602060000738 ]
Individual reflections 3.6.6.3.1. Individual reflections The data items in these categories are as follows: (a) REFLN (b) REFLN_SYS_ABS The bullet () indicates a category key. Where multiple items within a category are marked with a bullet, they must be taken together to form a compound key. The arrow () is a ...

Reflection measurements
Fitzgerald, P. M. D., Westbrook, J. D., Bourne, P. E., McMahon, B., Watenpaugh, K. D. and Berman, H. M.  International Tables for Crystallography (2006). Vol. G, Section 3.6.6.3, pp. 162-164 [ doi:10.1107/97809553602060000738 ]
Reflection measurements 3.6.6.3. Reflection measurements The categories describing the reflections used in the refinement are as follows: REFLN group Individual reflections (3.6.6.3.1) REFLN REFLN_SYS_ABS Groups of reflections (3.6.6.3.2) REFLNS REFLNS_SCALE REFLNS_SHELL REFLNS_CLASS Data items in the REFLN category can be used to give information about the ...

History of the refinement
Fitzgerald, P. M. D., Westbrook, J. D., Bourne, P. E., McMahon, B., Watenpaugh, K. D. and Berman, H. M.  International Tables for Crystallography (2006). Vol. G, Section 3.6.6.2.5, p. 162 [ doi:10.1107/97809553602060000738 ]
... International Tables for Crystallography (2006). Vol. G, ch. 3.6, p. 162 International Union of Crystallography 2006 | home | resources | advanced search ...

Equivalent atoms in the refinement
Fitzgerald, P. M. D., Westbrook, J. D., Bourne, P. E., McMahon, B., Watenpaugh, K. D. and Berman, H. M.  International Tables for Crystallography (2006). Vol. G, Section 3.6.6.2.4, pp. 161-162 [ doi:10.1107/97809553602060000738 ]
Equivalent atoms in the refinement 3.6.6.2.4. Equivalent atoms in the refinement The data items in these categories are as follows: (a) REFINE_B_ISO (b) REFINE_OCCUPANCY The bullet () indicates a category key. In macromolecular structure refinement, displacement factors or occupancies are often treated as equivalent for groups of atoms. An ...

Restraints and refinement by shells of resolution
Fitzgerald, P. M. D., Westbrook, J. D., Bourne, P. E., McMahon, B., Watenpaugh, K. D. and Berman, H. M.  International Tables for Crystallography (2006). Vol. G, Section 3.6.6.2.3, pp. 160-161 [ doi:10.1107/97809553602060000738 ]
... NCS (c) REFINE_LS_RESTR_TYPE (d) REFINE_LS_SHELL (e) REFINE_LS_CLASS The bullet () indicates a category key. Where ... These program-specific representations have particular prefixes; thus the value p_bond_d is a bond-distance restraint as applied by ...

Analysis of the refined structure
Fitzgerald, P. M. D., Westbrook, J. D., Bourne, P. E., McMahon, B., Watenpaugh, K. D. and Berman, H. M.  International Tables for Crystallography (2006). Vol. G, Section 3.6.6.2.2, pp. 159-160 [ doi:10.1107/97809553602060000738 ]
Analysis of the refined structure 3.6.6.2.2. Analysis of the refined structure The data items in this category are as follows: REFINE_ANALYZE The bullet () indicates a category key. The arrow () is a reference to a parent data item. In small-molecule crystallography, there is general agreement on the metrics that should ...

Overall description of the refinement
Fitzgerald, P. M. D., Westbrook, J. D., Bourne, P. E., McMahon, B., Watenpaugh, K. D. and Berman, H. M.  International Tables for Crystallography (2006). Vol. G, Section 3.6.6.2.1, pp. 158-159 [ doi:10.1107/97809553602060000738 ]
Overall description of the refinement 3.6.6.2.1. Overall description of the refinement The data items in these categories are as follows: (a) REFINE (b) REFINE_FUNCT_MINIMIZED The bullet () indicates a category key. The arrow () is a reference to a parent data item. Items in italics have aliases in the core CIF ...

Refinement
Fitzgerald, P. M. D., Westbrook, J. D., Bourne, P. E., McMahon, B., Watenpaugh, K. D. and Berman, H. M.  International Tables for Crystallography (2006). Vol. G, Section 3.6.6.2, pp. 158-162 [ doi:10.1107/97809553602060000738 ]
... NCS (c) REFINE_LS_RESTR_TYPE (d) REFINE_LS_SHELL (e) REFINE_LS_CLASS The bullet () indicates a category key. Where ... These program-specific representations have particular prefixes; thus the value p_bond_d is a bond-distance restraint as applied by ...

Phasing data sets
Fitzgerald, P. M. D., Westbrook, J. D., Bourne, P. E., McMahon, B., Watenpaugh, K. D. and Berman, H. M.  International Tables for Crystallography (2006). Vol. G, Section 3.6.6.1.6, pp. 157-158 [ doi:10.1107/97809553602060000738 ]
Phasing data sets 3.6.6.1.6. Phasing data sets The data items in these categories are as follows: (a) PHASING_SET (b) PHASING_SET_REFLN The bullet () indicates a category key. Where multiple items within a category are marked with a bullet, they must be taken together to form a compound key. The ...

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