Sentence examples for interactions of the compounds from inspiring English sources

MM-PBSA per-residue energy decomposition identified important interactions of the compounds with specific TDP2 residues.

Atom number 2 is important and may be involved in dispersive interactions of the compounds with enzymes.

Docking simulations enabled the detection of key binding interactions of the compounds with AChE and revealed that they occupied mainly the catalytic active site.

Interestingly, studies of the interactions of the compounds with models of DNA indicate different mechanisms of actions with respect to cisplatin.

The interactions of the compounds with COX-2 and 5-LOX were supported by the physical parameters including Ki, Ka and ΔG.

In addition, strong binding interactions of the compounds with the amino acid residues were effective for the successful identification of α-glucosidase inhibitors.

In the development of a new drug entity, potential interactions of the compound with the cytochrome P450 superfamily metabolizing enzymes need to be ascertain.

The molecular interactions of the compound have been pictured using Hirshfeld surfaces and fingerprints plots and the results were compared with BZD+·mNPA−.

Moreover, the pleiotropic interactions of these compounds with the ECM and the cell surface might produce nonspecific and undesirable effects [ 20, 23, 39, 40].

This suggests that the interaction of the compounds with the soil was mainly hydrophobic interactions.

This was done by analyzing the interaction of the compounds 4a with the active sites of spinach KARI.