Sentence examples for modeling the active from inspiring English sources

The review shows that both of the enzymes CO and PHS have been widely attempted for modeling the active site.

By modeling the active site of this mutant and probing the role of active site residues with alanine substitutions, this work also illuminates the mechanistic features of O- and C-glycosylation.

It is found that potential chemical structures for drug testing can originate from natural products, design from modeling the active site of the biological target, modification of natural substances, hybridization of known drugs, or random screening of chemical diversity.

In other words, time-varying elastance acts as a way of modeling the active increase in pressure in the ventricles resulting from cardiac contraction.

After modelling the active site of this enzyme, Camitro's researchers have been able to predict what sort of substrates CYP 3A4 can capture, and how strongly.

An attempt at modelling the active natural reaction centers in the membrane environment is presented.

The same homologous GPCR structures used for modelling the structure of the TSHR TMD were used for modelling the active and inactive conformations of the FSHR and LHR TMDs.

We propose a consistent lattice Boltzmann equation (LBE) with baroclinic coupling between species and mixture dynamics to model the active scalar dynamics in multi-species mixtures.

We have investigated the structure and dynamics of the HIV-1 reverse transcriptase (HIV-RT) active site, by modelling the active conformation of the HIV-1 RT/DNA/deoxythymidine triphosphate (dTTP) ternary complex.

To model the active transcriptional programs, a co-regulation network is built by setting an edge between two significantly cooperative TF (details in Supplementary Information).

For enzymes such as sEH, with no active site transition metal, semiempirical QM methods can be used to model the active site chemistry, allowing the use of sampling methods, such as MD, for generation of free energy barriers.