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...

詳細記述

書誌詳細
主要な著者: Cooper, R, Thorn, A, Watkin, D
フォーマット: Journal article
言語:English
出版事項: International Union of Crystallography 2012
主題: