Sentence examples for molecules are given from inspiring English sources

Substructures and molecules are given as space separated SMARTS and SMILES.

Clickable example molecules are given on the web server to help the users for easily getting started.

Other specifically regulated signal transduction molecules are given in Table 2.

The educt and product molecules are given in SMILES notation [ 38].

The CG parameters for DPPC, DLPC, POPC, ions, and water molecules are given in ref (28).

The average scores, AUC values and associated Wilcoxon rank-sum P-values for all pairs of metal ions and small molecules are given Tables 1 and 2 in the Supplementary Materials.

The question is, can CO2 molecules be given an artificial leg-up into space, so that they leave the atmosphere in sufficient numbers to make a difference to climate change?

A table containing information about outlier molecules is given in the (Additional file 6: Table S3).

To make results as comparable to DNN as possible, only molecules were given side information in the form of fingerprints.

The observed LCST could be made to be reversible in an appropriate environment where the molecules were given enough molecular mobility.

The discrete formula for a set of ranked molecules is given as follows AUC = 1 nN ∑ i = 2 N A i ( I i − I i − 1 ), (1).