Sentence examples for compounds was selected from inspiring English sources

For training and monitoring data sets, (1) a random selection of inactive compounds was selected, and (2) the inactive compounds most similar to active compounds were chosen using MACCS fingerprint keys (75) and Tanimoto coefficient as a similarity measure.

A set of 91 most relevant compounds was selected by applying a Fisher ratio cut-off approach and most of them were selectively removed by one of the cigarette filter types.

Using advanced data selection wizard, the column containing the activity values (pIC50) of the compounds was selected as the dependent variable and the rest as independent variables.

A representative group of seven compounds was selected for detailed study: phenol, m-xylene, naphthalene, phenanthrene, 1-methylnaphthalene, dibenzofuran and carbazole.

An initial set of 27 compounds was selected based on deterrent effect (odor) in order to find suitable additives to lighter gas components.

A random sample of ChEBI compounds was selected from version 1.50 of ChEBI.

Thirty two compounds were selected and synthesized.

Ultimately, three BU-CMD compounds were selected based on their activity and specificity.

Finally most promising compounds were selected from molecular modeling studies.

The top-scored compounds were selected for binding affinity calculation.

Based on obtained results, lead compounds were selected.