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Doses for X-ray and electron diffraction: New features in RADDOSE-3D including intensity decay models.

Published version
Peer-reviewed

Repository DOI


Change log

Authors

Dickerson, Joshua L  ORCID logo  https://orcid.org/0000-0001-5049-4000
McCubbin, Patrick TN  ORCID logo  https://orcid.org/0000-0002-4046-6222
Brooks-Bartlett, Jonathan C 

Abstract

New features in the dose estimation program RADDOSE-3D are summarised. They include the facility to enter a diffraction intensity decay model which modifies the "Diffraction Weighted Dose" output from a "Fluence Weighted Dose" to a "Diffraction-Decay Weighted Dose", a description of RADDOSE-ED for use in electron diffraction experiments, where dose is historically quoted in electrons/Å2 rather than in gray (Gy), and finally the development of a RADDOSE-3D GUI, enabling easy access to all the options available in the program.

Description

Publication status: Published


Funder: Engineering and Physical Sciences Research Council; doi: http://dx.doi.org/10.13039/501100000266


Funder: Collaborative Computing Project Number 4 (CCP4), UK

Keywords

MicroED, RADDOSE‐3D, diffraction‐decay weighted dose, dose, graphical user interface, intensity decay model, radiation damage, Electrons, X-Ray Diffraction, Software

Journal Title

Protein Sci

Conference Name

Journal ISSN

0961-8368
1469-896X

Volume Title

33

Publisher

Wiley