Sentence examples for multiple crystalline conformations from inspiring English sources

The results show that the experiments using multiple crystalline conformations are significantly more prone to screening performance fluctuations (Figure 4).

Our previous study applying Machine Learning (ML) to post-docking analysis used Structural Interaction Fingerprint (SIFt) profiles created upon three different crystalline conformations of receptors [9,10].

The crystalline conformations of perylene polyimides (PPIs), with alkyl spacers varying in length from C3 to C12 are discussed.

The recognition that pharmaceuticals often exist in multiple crystalline forms solely differing in the arrangement of molecules, crystalline polymorphs, has led to an increase in activity directed towards efficiently screening for solid form diversity.

The hydrothermal process induced crystalline conformation due to enhanced chain mobility of PLA.

The results confirmed that the presence of PVA during the hydrothermal process stimulates the crystalline conformation of N6.

The energy or mobility of the molecules was not sufficient to adapt a favorable crystalline conformation.

Larger molecules often have multiple possible conformations of similar energy.

All other docking programs take the input ligand conformation and re-generate multiple ligand conformations during the search process.

Fig. 1 Correlation between the radii of gyration calculated using a single and multiple ligand conformations.

Under oxidative catalytic conditions, Fe-Pc may evolve via multiple redox/spin conformations.