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The mean 3D Euclidean distance between nodes predicted by the models and those extracted from the FE simulations was calculated to assess the performance of the models in the validation set.
The average over 200 simulations was calculated as follows: a v e.
The time interval used in the simulations was calculated automatically based on the Courant-Friedrichs-Lewy condition.
The distance between R169 and pT219 in various conformations sampled during the MD simulations was calculated using ptraj module of AMBER and other in-house PERL scripts.
The average monetary net benefit across the 10,000 simulations was calculated for each catheter type along with 95% confidence intervals (CIs).
For each parameter set, the mean result of 100 simulations was calculated and compared to the biological data, in order to calculate a fitness value corresponding to the similarity between the mean model results and the biological data.
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For each simulated scenario the mean value and SD over the 50 simulations were calculated for each of the reproductive performance indicators.
Numerical simulations are calculated to demonstrate the effectiveness of the proposed synchronization scheme and verify the theoretical results.
Furthermore, the suitable loading paths for the left hand side of FLD by theoretical formulas and for the right hand side of FLD by finite element (FE) simulations are calculated.
The simulations were calculated for PP chains having 100 200 skeletal bonds, for several temperatures from 481 to 650 K, and for varying filler particle sizes (up to 100 Å).
The interatomic forces in MD simulations are calculated from the interatomic potentials.
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Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com