Sentence examples for model complexes have from inspiring English sources

Transition metal and ligand hyperfine coupling constants for paramagnetic vanadium and copper model complexes have been calculated using DFT methods that are available in commercial software packages.

Even in that case, the LSTa AV18 and LSTa NY18 model complexes have the same geometry at the beginning of the MD simulations.

More significantly, the argument based on N2 cleavage and catalytic N2 fixation by Mo model complexes has lost ground by the quite recent discovery of Fe model complexes that cleave N2 (Holland and covworkers) and indeed that also catalytically fix N2 (Peters and co-workers).

The protocols for modeling these complexes have been described earlier.

In this work, [MX2(R2Pcomplexes complexes have been modeled and studied by density functional theory (DFT).

This is contrary to synthetic small molecule model complexes, which often have issues with product inhibition.

While numerous techniques and frameworks for modeling complex systems have previously been devised (Niazi 2011), clearly one of the most explicit and intuitive methodology is the modeling of interactions using networks (Niazi and Hussain 2012).

This chapter shows that modeling complex systems has to take some practical issues into consideration, since the usefulness of the resulting model may be restricted by its subsequent use.

The final model of the complex has an R-factor of 20.6% (Rfree 25.2%).

Thus, our structural model of AFP-PTEN complex has explained these biochemical data that AFP could bind to PTEN and result in upregulating the P13K/AKT signal pathway.

Drosophila melanogaster has been widely used as a model of human Mendelian disease, but its value in modeling complex disease has received little attention.