Cargando…
DSR: enhanced modelling and refinement of disordered structures with SHELXL
One of the remaining challenges in single-crystal structure refinement is the proper description of disorder in crystal structures. This paper describes a computer program that performs semi-automatic modelling of disordered moieties in SHELXL [Sheldrick (2015 ▶). Acta Cryst. C71, 3–8.]. The new pro...
Autores principales: | , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4453980/ https://www.ncbi.nlm.nih.gov/pubmed/26089767 http://dx.doi.org/10.1107/S1600576715005580 |