Sentence examples for fitting of compounds from inspiring English sources

Figure 2A and 2B illustrate the aggregation curves of compounds 3 and 4, respectively and figure 3A illustrates the IC50 curve fitting of compounds of type I. Ibuprofen was used as a reference for the inhibition of platelet aggregation (Figure 3A) and as expected, showed an inhibition of platelet aggregation with an IC50 of 0.5 ± 0.11 μM (n = 3).

Higher docking scores correspond to higher fitting of compounds into the protein structures.

This confirms not only, as expected, the high instrument precision of NMR [ 39], but also that our fitting of compounds was very reproducible.

All individual curves are based on the regression fits of the compounds tested alone (Table 2).

A third line of evidence is based on the hourly fluctuations of FA-normalized mean abundances; using our Fourier fits of cyclic compound abundances, we estimated the minimum cyclic turnover rate which was highest for Clusters 4 (short chain alkenes, 135%/day) and 5 (methyl-alkanes, 160%/day) and averaged 97% over all compounds in LD.

Early applications used least-squares fitting of individual pixels to standard compound spectra, but more recently single value decomposition (SVD) has become established as the best method for efficiently providing the least-squares solution (see section 2.10 for a discussion of SVD).

This adjustment implies that a 'partial fit' of all compounds, except compound 5, was not allowed during the hypothesis generation process.

Molecular modeling studies were used to assess the fit of these compounds within the active site of human DHFR.

The docking experiments verified that such modifications can provide the reasonable fit of selected compounds with uPA active site.

Molecular docking of karrikins into the KAI2 pocket and of GR24 into the AtD14 pocket indicated a snug fit of these compounds in pockets lined by bulky aromatic side chains.

The task is to fit screening compounds into the binding site of the target, so that molecules are retrieved that are complementary to the protein cavity [10].