In addition to the potential for computation errors, manual bolus calculation does not take into account the effect of the active insulin that remains from the initial bolus ("insulin on-board").
The variability of this parameter was much lower than the one observed for basic cytotoxicity providing high potential for IC50 calculation.
While CML-CompChem has a great potential for QM calculations [13], its usefulness for MD and biomolecular simulations in general might be limited.
Warshel et al. [51] have studied this process in order to exemplify the use of the EVB approach as a reference potential for QM/MM calculations in the condensed phase.
The line represents the potential of confinement used for calculation.
In order to obtain a desired view direction to avoid occlusion, the artificial potential field was applied for calculation of rotation angles double wedge prisms.
The potential for attempting such calculations in the present circumstances is well defined by the success of previous similar examinations on the energetic materials PETN and RDX [7] and the inorganic materials calcite and sodium nitrate [34].
Coincidentally, 50 years ago, computers appeared for the first time, and as they became more generally available and useful, chemical engineers were amongst the first to recognise and exploit their potential for large scale calculations.
where I is current (A), V is voltage (V), E → is electric field intensity (V m), J → is current density (A m2), a is a surface enclosing the source electrode, l is the path length for potential calculation, and σ is the blood conductivity (the reciprocal of blood resistivity ρ).
A numerical two-dimensional method based on the potential flow theory is developed for calculation of non-dimensional power output from these turbines.
