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...

全面介绍

书目详细资料
Main Authors: Cooper, R, Thorn, A, Watkin, D
格式: Journal article
语言:English
出版: International Union of Crystallography 2012
主题: