Results 11 to 20 of about 20,530 (209)
Bayesian refinement of protein structures and ensembles against SAXS data using molecular dynamics. [PDF]
PLoS Computational Biology, 2017 Small-angle X-ray scattering is an increasingly popular technique used to detect protein structures and ensembles in solution. However, the refinement of structures and ensembles against SAXS data is often ambiguous due to the low information content of ...
Roman Shevchuk, Jochen S Hub
doaj +2 more sources
Reweighting of molecular simulations with explicit-solvent SAXS restraints elucidates ion-dependent RNA ensembles [PDF]
Nucleic Acids Research, 2021 Small-angle X-ray scattering (SAXS) experiments are increasingly used to probe RNA structure. A number of forward models that relate measured SAXS intensities and structural features, and that are suitable to model either explicit-solvent effects or ...
Mattia Bernetti, K. Hall, G. Bussi
semanticscholar +1 more source
Small, 2022 Nanostructured materials with high surface area and low coordinated atoms present distinct intrinsic properties from their bulk counterparts. However, nanomaterials' nucleation/growth mechanism during the synthesis process and the changes of the ...
Lingzhe Fang +3 more
semanticscholar +1 more source
Operando XAS/SAXS: Guiding Design of Single-Atom and Subnanocluster Catalysts.
Small Methods, 2021 Single-atom and subnanocluster catalysts (SSCs) represent a highly promising class of low-cost materials with high catalytic activity and high atom-utilization efficiency.
Lingzhe Fang +3 more
semanticscholar +1 more source
I22: SAXS/WAXS beamline at Diamond Light Source – an overview of 10 years operation
Journal of Synchrotron Radiation, 2021 Beamline I22, a versatile SAXS/WAXS beamline at Diamond Light Source, is presented, along with an overview of 10 years operation of the beamline.
Andrew J. Smith +14 more
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Analysis of SEC-SAXS data via EFA deconvolution and Scatter.
Journal of Visualized Experiments, 2021 BioSAXS is a popular technique used in molecular and structural biology to determine the solution structure, particle size and shape, surface-to-volume ratio and conformational changes of macromolecules and macromolecular complexes.
M. Tully +3 more
semanticscholar +1 more source
Journal of the American Chemical Society, 2020 Intrinsically disordered proteins (IDPs) have fluctuating heterogeneous conformations, which makes structural characterization challenging. Although challenging, characterizing the conformational ensembles of IDPs is of great interest, since their ...
Gregory-Neal W. Gomes +7 more
semanticscholar +1 more source
Structure-based screening of binding affinities via small-angle X-ray scattering
IUCrJ, 2020 Protein–protein and protein–ligand interactions often involve conformational changes or structural rearrangements that can be quantified by solution small-angle X-ray scattering (SAXS). These scattering intensity measurements reveal structural details of
Po-chia Chen +3 more
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Journal of Synchrotron Radiation, 2023 As part of its Extremely Brilliant Source (EBS) upgrade project, the ESRF's BM29 BioSAXS beamline was subject to a significant upgrade and refurbishment.
Mark D. Tully +18 more
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A small-angle X-ray scattering study of red blood cells in continuous flow
Journal of Synchrotron Radiation, 2023 Owing to their large penetration depth and high resolution, X-rays are ideally suited to study structures and structural changes within intact biological cells. For this reason, X-ray-based techniques have been used to investigate adhesive cells on solid
Jan-Philipp Burchert +4 more
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