Sentence examples for compounds structure from inspiring English sources

A negative effect of intramolecular hydrogen bonding in the compounds' structure is discussed.

These results may provide meaningful guidance to the further work including the similar lead compounds' structure modification and activity prediction.

Molecular Descriptors generated by E-DRAGON[55, 56]- E-DRAGON is the free online version of DRAGON and it generates a matrix of 1666 molecular descriptors for the dataset based on the compounds' structure [13].

Extraction of phenolic compounds from plant material depends on various factors like phenolic compounds structure, extraction method, particles size, sample storage conditions and presence of other compounds (they can interfere extraction or can be extracted with phenolics).

Taken together, these results suggest that: (i) compound bioactivities on different targets are not correlated, as indicated by the low performance of the Family QSAR model, and (ii) compound bioactivities depend on compounds structure, as highlighted by the low performance of the QSAM model.

The full descriptor set for each molecule of the training and independent validation sets is provided as supplementary material (Additional files 3 and 4): Molecular Descriptors generated by E-DRAGON[55, 56]- E-DRAGON is the free online version of DRAGON and it generates a matrix of 1666 molecular descriptors for the dataset based on the compounds' structure [13].

Other factors could be computationally analyzed based on compounds structures.

The obtained compounds' structures were confirmed by spectral data.

The compounds (structures and associated biological data) are exported from IBEX [4].

Compounds structures were confirmed by IR, 1H NMR, 13C NMR, and mass spectra.

We investigated the effect of these photochromic compounds' structures on E/Z photoisomerization under UV irradiation.