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Generation of crystal structures using known crystal structures as analogues
This analysis attempts to answer the question of whether similar molecules crystallize in a similar manner. An analysis of structures in the Cambridge Structural Database shows that the answer is yes – sometimes they do, particularly for single-component structures. However, one does need to define...
Autores principales: | Cole, Jason C., Groom, Colin R., Read, Murray G., Giangreco, Ilenia, McCabe, Patrick, Reilly, Anthony M., Shields, Gregory P. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4971547/ https://www.ncbi.nlm.nih.gov/pubmed/27484374 http://dx.doi.org/10.1107/S2052520616006533 |
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