The DIALS software for the processing of X-ray diffraction data is presented, with an emphasis on how the suite may be used as a toolkit for data processing. The description starts with an overview of the history and intent of the toolkit, usage as an automated system, command-line use, and ultimately how new tools can be written using the API to perform bespoke analysis. Consideration is also made to the application of DIALS to techniques outside of macromolecular X-ray crystallography.
DIALS as a toolkit.
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作者:Winter Graeme, Beilsten-Edmands James, Devenish Nicholas, Gerstel Markus, Gildea Richard J, McDonagh David, Pascal Elena, Waterman David G, Williams Benjamin H, Evans Gwyndaf
| 期刊: | Protein Science | 影响因子: | 5.200 |
| 时间: | 2022 | 起止号: | 2022 Jan;31(1):232-250 |
| doi: | 10.1002/pro.4224 | ||
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