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The analysis is based on pairwise relationships of potency difference and structure-similarity which were calculated from the combination of four different 2D and 3D structure representations.
Their thermodynamic properties (standard state entropy S°, standard enthalpy ΔfH° and standard Gibbs energy of formation ΔfG°) were calculated from the combination of density functional theory (DFT) at B3LYP/6-311G** level and isodesmic reactions.
In this work, genetic function approximation (GFA) and least squares support vector machine (LSSVM) models were developed for predicting the cytotoxicity of a great variety of ILs, including 9 types of cations and 44 types of anions, to Leukemia Rat Cell Line (IPC-81) based on the structural descriptors calculated from the combination of cations and anions.
The average user rate is calculated from the combination of resource partitioning factor and power control factor.
Fig. 9. (a) Expected number of M ≥ 5 earthquakes in 2009, calculated from the combination of background rate of M ≥ 3 shocks and spatially variable b-values.
The advantage of the proposed method compared with [23] and [24] is that ROIs can be extracted from all the fingers and the matching score can be calculated from the combination of all the fingers.
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Predicted marginal 5-year survival probabilities were calculated from the combined model for every combination of marker expression.
In order to describe the different behaviors of tension and compression, two separated damage variables denoted as ( D_{t} ) and ( D_{c} ) are defined, and the total scalar damage D is calculated from the weighted combination of them, namely: D = alpha_{t} D_{t} + alpha_{c} D_{c} (4).
The excellent consistency between Fig. 10D, the projection difference map calculated from the best combination of experimental data and Fig. 10E, the projection difference map calculated from models supports the movements of helices F and G obtained by electron crystallographic analysis.
Intensity ratios were calculated from the statistical combination of replicate profiles in order to increase the confidence in measurements, and to obtain fold-change values and associated ρ-values.
Impact estimates were based on hypothetical count trajectories that were calculated from the linear combinations of covariate values and parameter estimates for the years after WNV emergence.
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