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In this approach, the DE initially starts the minimization by generating consecutively more fitting generations.
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The minimization is achieved by generating anisotropic triangles in the three dimensional space.
This cautions about possible adverse effect of excessive energy minimization on generating a database of ligand conformations for virtual screening.
The TNCG minimization method was used for the energy minimization of structures generated by conformational search (35).
Energy minimization of generated model was by CHARMm [34] force field, a implicit distance-dependent dielectric constant and a non-bonded atom cut-off 12 angstrom, by the Adopted Basis Newton-Raphson energy minimization.
Identical amino acid changes were made to both the d- and l-Thy bound dCK structures via fixed backbone side chain replacement followed by independent energy minimizations to generate a structure ensemble.
Therefore, we have left the energy minimization of the generated models to users in real applications when they have a specific protein partner to be bound by the peptide.
Randomization was using Jensen's [ 17] computerized minimization method, which generated a random number each time.
A mathematical model of vertical wheelset/track interaction is developed and adopted for minimization of sound power generated by railway sleepers (mono-bloc or bi-bloc).
For a given model, P and N are fixed, so AIC minimization reduces to SSE minimization by least squares.
Maximum thermodynamic performance is achieved by minimization of the entropy generated in the assemblies.
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