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Potential metal-binding sites were designed within hMT-2 on the basis of structures generated by homology modeling.
His216 is a well-conserved residue in pyruvate carboxylases and, on the basis of structures of the enzyme, appears to have a role in the binding of MgATP, forming an interaction with the 3′-hydroxyl group of the ribose ring.
As a mediator, 5-HT exerts its actions by means of interaction with distinct receptors, which are differentiated on the basis of structures, molecular mechanisms and pharmacological profiles [ 9].
On the basis of structures of mispaired bases embedded in DNA duplexes (8, 9), non-W−C base pairs can be classified into three groups according to their distinct C1′−C1′ distance relative to W−C base pairs: (i) large Pu-Pu mis pairs, (ii) similar size of Pu-Py mispairs, and (iii) small Py-Py mispairs.
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Eight molecules were selected on the basis of structure diversity to build 10 different pharmacophore models.
Because of these characteristics, they appear to be suitable for comparative studies to elucidate the basis of structure-function relationships.
Docking and scoring large libraries of ligands against target proteins forms the basis of structure-based virtual screening.
The fracture and strengthening mechanisms of Cu/Ti3SiC2/C nanocomposites are explored on the basis of structure and composition of Cu/Ti3SiC2/C nanocomposites with formation and function of interface.
In this study, we designed and synthesized a series of 1 (C4) analogs on the basis of structure activity relationship and molecular modeling.
The ongoing expansion of our knowledge about the molecular basis of structure and function of diverse biological entities and processes presents us with both huge opportunities and challenges to improve our understanding of disease.
If on the other hand, the nervous system made an inference about the structure of the observations, it could detect such stimuli on the basis of structure (correspondence) oddity.
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