Sentence examples for rationalize simulation from inspiring English sources

Dimensionless scaling groups which quantify the balance between the forces causing fluid flow were computed between well pairs to rationalize simulation results.

In order to rationalize our simulation results, we have employed an analytical theory proposed by Bacon and Scattergood (1982) which is extended phenomenologically to treat all anchoring defects, including C15 clusters and 〈1 0 0〉 loops.

Physical explanations are provided for rationalizing the simulation results.

Second, the simulations rationalize the results of the otherwise puzzling slope analysis of the T1 accumulator under the unequal reward conditions (Fig. 10).

Molecular dynamics simulation to rationalize regioselective hydroxylation of aromatic substrates by soluble methane monooxygenase.

Molecular dynamics simulations helped rationalize the observed bromodomain selectivity for exemplar BET inhibitors and a congeneric series of tetrahydroquinolines (THQ) that differed by a single heteroatom near the ZA channel.

We extracted several proteins from different plant sources [Triticum aestivum (TA), Aegle marmelos (AM), Ricinus communis (RC), Jatropha curcas (JC) and Simarouba glauca (SG)] followed by evaluation of their optical properties and simulations to rationalize observed surface plasmon resonance.

Furthermore, the binding mode of the active compound 7d was rationalized by molecular simulation studies.

The SAR findings revealed in this study has been well rationalized by docking simulation of the key compounds against the crystal structures of the relevant hCA isoforms.

Using molecular simulations and a theoretical model we rationalize how force induces such barrier in an otherwise downhill free-energy surface.

It is hoped that this is just the beginning for reliable simulations that can rationalize experimental observations and then can be used to predict and design new experiments.