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Thus, we examined the potential effect of the NA-N248D (Figure 5B) by utilizing the crystal structure of the H5N1 neuraminidase (PDB entry: 2HU4) as a structural template.
The molecular docking in this study was carried out utilizing the crystal structure of FXa (PDB ID: 1IQI).
We here describe an in silico, pocket-based drug discovery methodology utilizing the crystal structure of the Ku70/80 heterodimer.
Dihydrofuran-2-one and dihydropyrrol-2-one derivatives were identified as novel, potent and selective mineralocorticoid receptor (MR) antagonists by the structure-based drug design approach utilizing the crystal structure of MR/compound complex.
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X-ray diffraction was utilized for the crystal structure characterization of the GaN nanowall network as shown in Fig. 4.
Here, we describe bisdionin F, a competitive AMCase inhibitor with 20-fold selectivity for AMCase over chitotriosidase, designed by utilizing the AMCase crystal structure and dicaffeine scaffold.
Utilizing the SSB crystal structure, 6 7 nt per hotspot were found within a 5 7 Å distance.
At the second level (middle), the range of possible x SSB is refined by utilizing the (SSB 65 crystal structure.
High-resolution transmission electron microscopy is utilized to examine the crystal structure of a silicon nitride ceramic using focus variation methods to achieve sub-ångström resolution at the absolute theoretical information limit of the transmission electron microscope.
Since CSP was recently also successfully utilized to determine the crystal structure of a sub-micrometer-sized crystallite (present in picogram amounts) in a bulk consisting of a different polymorph, 132 it is viable that CSP could aid the structural characterizations of small molecular impurities that potentially act as crystal seeds for the formation of unanticipated crystal forms.
We have utilized the GNNQQNY crystal structure and high-temperature molecular dynamics simulation in explicit solvent to study the disaggregation mechanism of the GNNQQNY fibrils and to infer its likely aggregation pathways.
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