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Summary of experimental properties.
Even though the first release of Metrabase includes calculated molecular properties only, the 'properties.type' field values of 'c' and 'e' are proposed to designate calculated and experimental properties respectively, for possible future addition of experimental properties.
Recall that ideal observer performance is representative of the relative amount of information for the task across experimental properties and conditions.
The rheological results of the simulation were confirmed by the convergence of the stress autocorrelation function, whereas experimental properties were measured using a rheometer.
The experimental properties of the AunSi (n=1-8) nanoalloy clusters are correlated in terms of DFT based descriptors viz.
Conceptual DFT based descriptors have been invoked to correlate the experimental properties of nano compounds and composites.
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The prediction errors are depicted using residual plots (i.e., scatterplots with experimental property versus residual error).
Each descriptor involved has a scatterplot with the descriptor versus the experimental property, as well as a histogram of the descriptor values.
The model calculates a progressive reduction in structural properties with increasing size of microvascular channels due to increased ply waviness, which was confirmed using experimental property data.
Alternatively, we need at least as many experimental property data points as the number of model parameters to parameterize the equation of state.
A predictive structureproperty model was created by regressing experimental property data for a set of representative polymeric vehicles with structural descriptors.
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Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com