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An orientation-independent Raman spectrum of adsorbed CD3CN should be obtained before quantitatively comparing the integrated C≡N stretch intensity with its liquid counterpart.
Furthermore, the CO2 asymmetric stretch intensity is enhanced when the IR light is polarized along the crystal length, indicating that the average alignment of the CO2 molecules is oriented along the channels.
The pyruvate C=O stretch intensity profiles show some variations under different conditions, but the following differences in C- and N-labeled and unlabeled LDH complexes are consistently observed.
All this is consistent, as shown in Figure 5, with a shift of the C2=O stretch intensity profile in the (D168N LDH·NADH·pyruvate complex ensemble toward conformations with much less propensity toward chemistry.
Figure 4 B,C depicts the relative C≡N stretch intensity at 2275 cm–1 of CD3CN adsorbed in the SP-MOR along the crystallographic ac and bc planes as a function of angle θ between laser polarization and the crystallographic b-axis.
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It was concluded that metallic Pd was the catalytically active species, an assertion re-affirmed in subsequent in situ ATR-IR/XAS measurements of benzyl [152, 153, 154] and cinnamyl alcohol [155] selox in toluene and under supercritical CO2, respectively, wherein the C=O stretching intensity was assumed to track alcohol conversion.
Stretching intensity was maintained at moderate intensity, as recommended by American College of Sports Medicine guidelines.
Clusters were detected automatically using a custom-made algorithm that first enhanced the contrast of images using a histogram stretching intensity transformation.
Whereas weak or moderate H-bond stretching intensities are obtained for acetogenins with slightly bent carbon chain structures the strongest hydrogen bond intensities are calculated for molecules with a 45° V-type backbone structure.
In addition, the most red-shifted pyruvate C=O stretch band intensity at 1674 cm 1 has a significantly higher intensity in the unlabeled LDH (33% of bound pyruvate vs 11%), and the substate population distribution is also more evenly spread.
Likewise, the 1489 cm 1 component of the symmetric thiophene C=C stretch derives intensity from ordered PBTTT chains in bimolecular crystals, where side group and backbone order is improved.
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