Sentence examples for fitted structure from inspiring English sources

After simultaneous IQP fitting, the lowest RMS error for the fitted structure is 8.6 Å with respect to the crystal structure, and only slightly larger than our results observed for simulated maps.

Table 3 Comparison of surface structure parameters for the (100) surface goethite + water between PBE96 AIMD and PBE96 + Grimme2 AIMD simulations of Fe24O60H48 + 53 H2O and fitted structure from CTR experiments of Ghose et al. [22] Surface structure parameters PBE96 AIMD PBE96 + Grimme2 AIMD Exp.

For example, the best fitted structure of the four-component assembly 2BO9 has an RMS error of 1.7 Å.

Once f has been determined, the full embedding space is warped and the atomic positions of the fitted structure are mapped accordingly.

The fitted structure is the stigmatellin-bound form, but the Rieske domains also protruded from the map when the uninhibited form was used instead (not shown).

We then monitored the system for convergence by calculating the root mean squared deviation between the coordinates of the fitted structure and the starting model.

But in 1897 The New York Tribune boomed that it was "one of the most sumptuously fitted structures" anywhere, adding, "few of the Old World places... can compare with its richness of architectural fibre and interior finish".

To construct the tandem converters, it is shown that, for both mechanically-stacked and series-interconnected configurations, the GaInAsSb alloy's optimum bandgap Eog dependence on the emitter temperature TBB easily yields a quadratic equation Ego="αTBB2+βTBB+γ with α, β, and γ the fitted structure-dependent parameters.

For pure bundle simulations the body fitted structured meshes are suggested, since slightly better agreement can be captured considering all quantities with the same number of cells.

The fitted structures can be used to calculate mutual RMSD values, as well as other more sophisticated measures of structural similarity such as the global distance test (GDT, the metric used in CASP).

The final fitted structures were selected based on the RMSD and the CCC, after reaching a plateau within 400 ps of simulation time (Supplementary Figure S6).