CRYSTALS enhancements: asymmetric restraints
The traditional Waser distance restraint, the rigid-bond restraint and atomic displacement parameter (ADP) similarity restraints have an equal influence on both atoms involved in the restraint. This may be inappropriate in cases where it can reasonably be expected that the precision of the determina...
Hauptverfasser: | Cooper, R, Thorn, A, Watkin, D |
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Format: | Journal article |
Sprache: | English |
Veröffentlicht: |
International Union of Crystallography
2012
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Schlagworte: |
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