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MolDStruct: Modeling the dynamics and structure of matter exposed to ultrafast x-ray lasers with hybrid collisional-radiative/molecular dynamics.
J Chem Phys. 2024 May 14;160(18):184112. doi: 10.1063/5.0197225.
J Chem Phys. 2024.
PMID: 38726930
Coherent diffractive imaging of proteins and viral capsids: simulating MS SPIDOC.
Kierspel T, Kadek A, Barran P, Bellina B, Bijedic A, Brodmerkel MN, Commandeur J, Caleman C, Damjanović T, Dawod I, De Santis E, Lekkas A, Lorenzen K, Morillo LL, Mandl T, Marklund EG, Papanastasiou D, Ramakers LAI, Schweikhard L, Simke F, Sinelnikova A, Smyrnakis A, Timneanu N, Uetrecht C; MS SPIDOC Consortium.
Kierspel T, et al. Among authors: dawod i.
Anal Bioanal Chem. 2023 Jul;415(18):4209-4220. doi: 10.1007/s00216-023-04658-y. Epub 2023 Apr 4.
Anal Bioanal Chem. 2023.
PMID: 37014373
Free PMC article.
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Structural Heterogeneity in Single Particle Imaging Using X-ray Lasers.
Mandl T, Östlin C, Dawod IE, Brodmerkel MN, Marklund EG, Martin AV, Timneanu N, Caleman C.
Mandl T, et al. Among authors: dawod ie.
J Phys Chem Lett. 2020 Aug 6;11(15):6077-6083. doi: 10.1021/acs.jpclett.0c01144. Epub 2020 Jul 16.
J Phys Chem Lett. 2020.
PMID: 32578996
Free PMC article.
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