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Description
(Diffraction Integration for Advanced Light Sources) a software project for the analysis of crystallographic diffraction images for many new methods from shutterless, fine-sliced rotation scans to randomly-oriented snapshots of serial crystallography. It uses multiple CPU and GPU machines to increase speed and accuracy based on a comprehensive physical model.
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Usage Notes
Version control for DIALS is described on https://sbgrid.org/wiki/examples/DIALS_version_control
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Primary Citation*
G. Winter, D. G. Waterman, J. M. Parkhurst, A. S. Brewster, R. J. Gildea, M. Gerstel, L. Fuentes-Montero, M. Vollmar, T. Michels-Clark, I. D. Young, N. K. Sauter, and G. Evans. 2018. DIALS: implementation and evaluation of a new integration package. Acta Crystallographica Section D, Structural Biology. 74(2): 85-97.
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Tales
Nicholas Sauter began working on DIALS (Diffraction Integration for Advanced Light Sources) in 2011 because he and his colleagues recognized that the experimental methods of X-ray crystallography were changing, and changing fast. To be usable, the software that automates crystallography experiments must be able to keep up.
So he and his team at Lawrence Berkeley National Laboratory and collaborating teams at CCP4 and at the Diamond Light Source synchrotron in the United Kingdom developed a modular system that allows new algorithms to be dropped in as new experimental methods and technologies emerge. Examples include handling data from faster detectors, like the Pilatus, handling new technologies, such as the X-ray free electron laser (XFEL), and handling new types of experiments, such as putting multiple crystals in the beamline at …
Read More.
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Webinars
Topic: Processing serial crystallographic data using cctbx.xfel and DIALS
Presenter: Aaron Brewster, Project Scientist, Lawrence Berkeley National Laboratory
Host: Jason Key
Recorded on January 10, 2016
Topic: DIALS
Presenter: Graeme Winter, Scientist, Diamond Light Source
Host: Jason Key
Recorded on November 17, 2015
Topic: DIALS: Advanced Data Reduction
Presenter: Nicholas Sauter, Lawrence Berkeley National Labs
Presented as part of:
SBGrid/NE-CAT 2014: Data Processing in Crystallography
June 5-6, 2014
