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This assignment was achieved in one of two ways.
Complete assignment was achieved on the basis of 2D experiments (COSY, HSQC, HMBC) using Varian VNMR software.
Vibrational assignment was achieved by comparison of observed band position and intensity in the FTIR and FT-Raman spectra with wavenumbers and intensities from Hartree-Fock (6-13G∗ level) and Density Functional Theory (DFT) calculations.
No adjustments were additionally made since the treatment assignment was achieved using a randomisation procedure.
Dendrogram construction and band assignment was achieved using BioNumerics software version 3.5.
Function assignment and cluster boundary assignment was achieved with single crossover homologous recombination by using plasmid pK18mob2.
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Thus, the optimal one-to-one assignment is achieved when the function shown below is minimized.
To close that impedimental analytical gap, the conformers of 4,4′-MDI and their vibrational properties are explored by DFT calculations and accurate IR band assignment is achieved for the first time by detailed comparison with measured spectra.
The equilibrium assignment is achieved by the action of the coordinator which solves an optimization problem involving a two-time-scale system; the coordinator action is slow compared to the fast dynamics of the agents.
For leucine-selective N labelling, the Neidhardt et al. [ 35] protocol for amino acid-supplemented Mops was followed by the substitution of [N]leucine (Cambridge Isotope Laboratories); fractional C labelling for stereo-specific methyl assignments was achieved with 10% U-[C/H]glucose.
Their subsequent elimination resulted in a reduced-size binder with very similar affinity for NT, for which near-complete backbone assignments were achieved.
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