Litcius/Paper detail

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

Joshua L. Dickerson, Patrick T. N. McCubbin, Jonathan C. Brooks‐Bartlett, Elspeth F. Garman

2024Protein Science16 citationsDOIOpen Access PDF

Abstract

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/Å 2 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.

Topics & Concepts

DiffractionElectronElectron diffractionIntensity (physics)FluencePhysicsX-rayX-ray crystallographyComputational physicsComputer scienceOpticsNuclear physicsIrradiationElectron and X-Ray Spectroscopy TechniquesX-ray Spectroscopy and Fluorescence AnalysisRadioactive element chemistry and processing