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In the case of phospholamban, the restrained ensemble sampled the conformational interconversion between T (helical) and R (unfolded) states for the cytoplasmic region that could not be observed using standard structural refinements with the same experimental data set.
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The method is shown to converge with mesh refinement with the same order of accuracy as the height-function method for all three types of meshes tested, i.e. Cartesian, triangular, and polygonal.
Moreover, we have proposed a very efficient stochastic parallel refinement method, which is able to find the global optimum with only a small fraction of iterations in comparison to the independent sampling and refinement with the same sampling angle intervals.
The refinements of the same data with different fixed-values of peak-shift parameter lead to different values of reliability factor, R wp.
In a second set of refinements, we used the same protocol but with all restraints turned off.> High res.
Microstructural characterization showed a dendrite arm spacing (DAS) refinement of 40% when compared with the same part produced by conventional investment casting.
The Si particles in the composite are seen to induce a high dislocation density during deformation and lead to faster structural refinement than in a monolithic alloy with the same composition as the matrix.
And the following refinement was the same as that of the ligand bound form.
This estimate is very much more precise than that obtained with the same data in a conventional refinement.
More recently, a toolkit called GRENDEL was presented with the same purpose [ 17], including several refinements in order to increase the biological realism of the benchmark.
And Raphaël, André's other creation, the living continuation of his written work, who speaks with the patterns of his father, with the same blend of mildness and cold rage, of refinement and biting wit, with the same vocal quaver that causes one to wonder whether he is about to break into tears or declare an insurrection.
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Since I tried Ludwig back in 2017, I have been constantly using it in both editing and translation. Ever since, I suggest it to my translators at ProSciEditing.

Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com