Sentence examples for compounds with binding from inspiring English sources

X-ray structures show that each of 18 compounds with binding behavior bind specifically within the artificial cavity and not elsewhere in the protein.

These compounds were docked with MDM2 and two top scoring compounds with binding affinities of −10.13 and −9.80 kcal/mol were selected.

To search for chemical compounds with binding affinity to FecA1 of H. pylori, we used the COPICAT web-based software system [ 11].

The binding interactions of compounds with high binding affinity to Bcl-2 protein were analyzed.

Crystal aggregation is promoted by viscous binding, implying that crystal-foreign compounds with multiple binding sites, such as abnormally self-aggregating Tamm-Horsfall glycoprotein or other macromolecules, attach to crystal surfaces and act as a kind of glue [ 37].

To aid in our prediction process compounds showing free binding energy less than -4.00 were considered behaviourally active and compounds with free binding energy more than -4.00 were used for comparison.

A series of substituted chromones were designed, synthesized, and evaluated for their ability to bind melanin-concentrating hormone receptor 1. Compounds with subnanomolar binding affinity and 66% oral bioavailability in rats were discovered.

The only two compounds have been identified (see Table 2) having simultaneously high negative SOL and DISCORE binding energies after postdocking optimization of all these 74 compounds (including those 6 compounds with SOL binding energy below −7 kcal/mol).

The volume changes accompanying ligand binding to proteins are thermodynamically important and could be used in the design of compounds with specific binding properties.

In this work, the binding energies, inhibition constants and binding modes of a group of previously synthesized Piperine derivatives at the binding site of Survivin have been studied using molecular docking tools and the best compounds with minimum binding energies are proposed as potential drugs for the inhibition of Survivin.

Further optimization resulted in compounds with improved binding affinities and antagonist profiles, in vitro.