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Start-to-end simulation of single-particle imaging using ultra-short pulses at the European X-ray Free-Electron Laser.

Authors :
Fortmann-Grote C
Buzmakov A
Jurek Z
Loh ND
Samoylova L
Santra R
Schneidmiller EA
Tschentscher T
Yakubov S
Yoon CH
Yurkov MV
Ziaja-Motyka B
Mancuso AP
Source :
IUCrJ [IUCrJ] 2017 Sep 01; Vol. 4 (Pt 5), pp. 560-568. Date of Electronic Publication: 2017 Sep 01 (Print Publication: 2017).
Publication Year :
2017

Abstract

Single-particle imaging with X-ray free-electron lasers (XFELs) has the potential to provide structural information at atomic resolution for non-crystalline biomolecules. This potential exists because ultra-short intense pulses can produce interpretable diffraction data notwithstanding radiation damage. This paper explores the impact of pulse duration on the interpretability of diffraction data using comprehensive and realistic simulations of an imaging experiment at the European X-ray Free-Electron Laser. It is found that the optimal pulse duration for molecules with a few thousand atoms at 5 keV lies between 3 and 9 fs.

Details

Language :
English
ISSN :
2052-2525
Volume :
4
Issue :
Pt 5
Database :
MEDLINE
Journal :
IUCrJ
Publication Type :
Academic Journal
Accession number :
28989713
Full Text :
https://doi.org/10.1107/S2052252517009496