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Efficient structure-factor modeling for crystals with multiple components

Diffraction intensities from a crystallographic experiment include contributions from the entire unit cell of the crystal: the macromolecule, the solvent around it and eventually other compounds. These contributions cannot typically be well described by an atomic model alone, i.e. using point scatte...

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Detalles Bibliográficos
Autores principales: Afonine, Pavel V., Adams, Paul D., Urzhumtsev, Alexandre G.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10317137/
https://www.ncbi.nlm.nih.gov/pubmed/37338214
http://dx.doi.org/10.1107/S205327332300356X