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17 out of the 18 experimentally observed crystal forms of these molecules are found among the first two most stable predicted crystal structures.
Of interest, the red-flour beetle (Tribolium castaneum) has the highest number of unique stems predicted for any insect as well as the most stable predicted stem structures for all insects.
Secondary structure prediction of this 108 nt transcript was performed by the Mfold program http://mfold.rna.albany.edu/, and the most stable predicted structure is shown in Figure 5B.
For a given coding sequence, the tabulated Δ G for an off-target complex is the most stable predicted of the 3 possible overhangs for that coding sequence.
Figure 2 shows the ΔG of formation for the most stable predicted secondary structure of the full-length transcript, as a function of reaction temperature.
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Two isomers of C59N CF3 11 were characterized and assigned to the most stable isomers predicted by DFT.
The most stable atomic structure predicted by the surface phased diagram shows that Ir atoms prefer to stay on the surface of the alloy ensuring their exposure to the incoming gas.
The X-ray analysis performed on 3-nitroso-2-phenyl imidazo[1,2-a]pyridine, as well as other diffraction studies reported in the literature on analogous molecules, indicate that the solid-state geometry is closely related to the most stable conformational structures predicted by theoretical calculations.
A computational study published in 2004 predicted that the known crystal Form I is the most stable, but it also predicted the existence of a second polymorph that exhibits virtually the same crystal lattice energy as the known form.
The predicted most stable secondary structures of the negative-sense sequences were more variable.
Furthermore, the most stable surface structures are predicted for different experimental conditions.
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