Sentence examples for the ensemble of structures from inspiring English sources

Comparison of these ensembles and the ensemble of structures previously generated for αS reveals specific differences in the structural preferences of the three proteins and allows the effects of the hydrophobic core on the structural properties of these forms of synuclein, including their different aggregation propensities, to be examined at a molecular level.

The ensemble of structures resulting from these simulations exhibited unknotted chromosomes, phase separation of chromatin types, and a tendency for open chromatin to lie at the periphery of chromosome territories.

From the ensemble of structures, a pseudo-crystallographic electron density map is calculated, and then conventional crystallographic refinement methods are used to best fit a single, optimal structure into the density map.

The molecular scaffold results can be conceived as collapsing the ensemble of structures mapped to a target in progressive stages of abstraction.

The likelihoods are calculated using the ensemble of structures present at the end of the corresponding pass.

Thus, they are a metric of how consistent a given assignment is with the ensemble of structures at the end of each calculation pass[15].

As noted above, the agreement between the experimentally derived and calculated "free" PRE distances is almost as good as for the "working" PRE distances (Table 3), allowing a high level of confidence that the ensembles of structures provide a good representation of the long-range structural properties of αS, βS, and βSHC.

The heterogeneity and broadness of the ensembles of structures characteristic of disordered states of proteins make the determination of the conformational properties of IDPs particularly challenging.

The ensembles of structures are stored using the standard PDB format for multiple models, with B-factors listed as computed from the TLS model and overall B-factor scaling contributions.

To provide further evidence that the ensembles of structures produced here are valid representations of the experimental ensembles, cross-validation, in which only 80% of the PRE-derived distance restraints were used in the PRE-RMD calculations ("working") and the remaining 20% provide a "free" data set whose satisfaction is not preordained by their inclusion as restraints, was conducted.

SEN relies on the sampling of suboptimal structures from the ensemble of secondary structures.