Sentence examples for compounds in the model from inspiring English sources

As shown in Fig. 3, EtOH was the best extractant for removing oxidized thiophenic compounds in the model oil.

Table 4 shows the subset of rules extracted from the regression tree satisfying the criterion that each rule covers at least 10 compounds in the model selection dataset – where the coverage of a rule is the number of compounds satisfying the conditions in the antecedent of the rule.

The best results were obtained with samples dosed for 9 days and including both high and a low concentration of the test compounds in the model.

Exchange reactions in the Yeast 5 GEM follow a convention of using compounds in the model as reactants, leading to exchange reactions of the form "reactant ->", with an entry of +1 in the stoichiometric matrix.

Final concentrations of PAHs, PBDEs and TBT in the test materials were as close as possible to the EQS levels always taking into account the limitations posed by the distribution of individual compounds in the model SPM for PAH and PBDE (Table  3).

Like QSAR models, QPAR models 1 and 2 were constricted based on all the evaluated compounds, in the models 3 and 4 the sesquiterpenos were excluded and the models 5 and 6 were constructed excluding sesquiterpenes and acyclic monoterpenes.

The additive features of these indirect and induced effects are compounded in the model through the Leontief Inverse Matrix [20].

First we examined each compound individually, categorized into quintiles of concentration, without including exposure from any other compound in the model.

Of the active compounds, 88.30% in the dataset are similar to the active compounds used in the model building, while ∼1.4% of the inactive compounds in the entire dataset are similar to one or more of the inactive compounds selected by the sampling procedure.

As we explained above, in order to take this into account we developed special tools to assess the differences between the chemical we want to predict and the compounds present in the model.

When a compound is highlighted, details about its prediction are reported, and it is possible to check the six most similar compounds found in the model database (see below for further details).