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It is a modified version of the BJ exchange correlation potential (introduced by Becke and Johnson [9]) to improve the bandgap prediction of the DFT-based methods.
The pumping potential, introduced as a measure of the volumetric efficiency, was determined both analytically, using the finite element method, and experimentally, using a built-in prototype.
A combination is identified between the world of the real and the infinite conditions of the possible: design analyses the mutations and seeks an alignment between the potential introduced and the reality on which intervention will take place.
This sensitivity threshold precedes a sharp increase in false positive rate and therefore excluding sites below the sensitivity threshold ensures that the number of cavities without ligand-binding potential introduced to the dataset is limited.
We speculate that the higher activity of CoPoIFN-α was likely due to the electrostatic potential introduced by residue Arg156 around the binding site or a structural perturbation caused by these different residues.
Coarse-grained simulations were carried out using the all-atom structure-based potential introduced in Ref. [18] and GROMACS 4 [60] equipped with PLUMED [61].
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This solvation "effective potential" introduces the intrinsic dependence of the proton levels in Figure 44 on a solvent reaction coordinate Q.
The concept of bi-potential, introduced by de Saxcé, extends the notion of pseudo-potential and enables to write the evolution laws as implicit normality rules.
There was also potential bias introduced by the recruitment strategies used to identify potential study participants.
Current design of the neutrino facility and its physics potential are introduced.
The scission energy and bending potential were introduced to model the interactions of micellar rods.
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