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Second, many of the tools can only calculate a subset of molecular descriptors, and the results from multiple tools need to be manually merged to generate a comprehensive set of descriptors.
We use the multislice method to directly calculate a subset of the rows of the S-matrix (corresponding to plane waves of various orientations), which is then used in a similar manner as Bloch wave calculations [38] to relate the output wavefunction to a given input.
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Our approximate hierarchical clustering algorithm first calculates a subset of pairwise distances and then performs agglomerative clustering based on these distances.
In order to exclude the effects of transmission among travelers or cases of disease imported by means other than air travel, we provide a revised estimate calculated from a subset of 228 cases.
A large number of descriptors were calculated and a subset of calculated descriptors was selected by genetic algorithm multiple linear regression (GA MLR).
In the original DMQ questionnaire a sum score is calculated; in the current study a sum score was calculated from a subset of items relating to upper extremity use.
The delta neutrophil index was automatically calculated as a subset of routine complete blood count test.
Estimates calculated using a subset of 92 cases interviewed within two years of diagnosis were not appreciably different from those calculated using the full case sample, suggesting that inclusion of cases with longer follow-up did not contribute to differential recall (results not shown).
The calculations for the sliding window means and confidence intervals were calculated from a subset of the intron frequency data, consisting of successive 25-bp windows between 1 and 5,000 bp.
Rotated stability represents typical performance and was calculated from a subset of the data taken during April 2012.
Main fibre diameter and orientation, as well as the degree of fibre alignment, were calculated, while a subset of the spun scaffolds were tested for their tensile properties.
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