Sentence examples for rationalize activities from inspiring English sources

Docking studies were also performed to rationalize activities of these derivatives.

Research is necessary on how to rationalize control activities so that control programs can adopt the most effective and efficient strategies.

The early phases of drug discovery use in silico models to rationalize structure activity relationships, and to predict the activity of novel compounds.

Their binding mode to FAAH was explored to rationalize their activity and give idea to design highly active inhibitors.

Indeed, it was an objective of Kurti and This to rationalize culinary activity as well as to modernize it (for example, to improve the efficiency of some traditional heating systems, in which the energy loss regularly reached 80 percent).

Finally, molecular modelling and simulation were used to explore binding characteristics of 5-oxo-ETE and derivatives with the aim to rationalize biological activity.

Typically, this occurred at an early stage (drug discovery and/or lead optimization) prior to an Investigational New Drug (IND) application, although sometimes in retrospective studies to rationalize biological activity.

They could barely rationalize this activity and were nakedly seeking to inflame emotions by targeting people whom the public revered.

Therefore, as an important component of the observed binding affinity, a molecular understanding of the conformational changes upon receptor binding that a ligand undergoes could be harnessed to rationalize structure-activity relationships and design ligands with better affinity.

Herein, we have presented an update on the state-of-the-art in rationalizing activity cliffs.

The molecular docking was performed for all the synthesized compounds to assess their binding affinities to GABA-A receptor in order to rationalize their anticonvulsant activities in a qualitative way.