Articles with "crystallographic structure" as a keyword



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Synthesis, Crystallographic Structure, Theoretical Analysis, Molecular Docking Studies, Electronic properties and Biological Activity Evaluation of ruthenium-complex bearing N-heterocyclic carbene ligand

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Published in 2023 at "New Journal of Chemistry"

DOI: 10.1039/d3nj01598j

Abstract: The development of new classes of antimicrobial is urgently needed due to the widespread occurrence of multi-resistant pathogens. In this study, novel ruthenium N-Heterocyclic carabene 3 was synthesized and characterized... read more here.

Keywords: structure theoretical; theoretical analysis; crystallographic structure; ruthenium ... See more keywords
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Thermal stability of the crystallographic structure of nanocrystalline Nd0.7Sr0.3MnO3 manganite with enhanced magnetic properties

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Published in 2020 at "AIP Advances"

DOI: 10.1063/5.0017299

Abstract: We report the effect of temperature on the crystallographic structure and magnetic properties of ultrasonically prepared nanostructured Nd0.7Sr0.3MnO3 perovskite manganite. The crystal structure of as-synthesized nanoparticles remains unaltered over a wide scanning temperature range. Temperature… read more here.

Keywords: 3mno3 manganite; nd0 7sr0; magnetic properties; 7sr0 3mno3 ... See more keywords
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Crystallographic structure versus homology model: a case study of molecular dynamics simulation of human and zebrafish histone deacetylase 10

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Published in 2019 at "Journal of Biomolecular Structure and Dynamics"

DOI: 10.1080/07391102.2019.1691658

Abstract: Abstract Histone deacetylase (HDAC) 10 has been implicated in the pathology of various cancers and neurodegenerative disorders, making the discovery of novel inhibitors of the isoform an important endeavor. However, the unavailability of crystallographic structure… read more here.

Keywords: crystallographic structure; histone deacetylase; molecular dynamics; structure ... See more keywords
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On Ve-Degree-Based Irregularity Properties of the Crystallographic Structure of Molecules

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Published in 2021 at "Journal of Chemistry"

DOI: 10.1155/2021/9928543

Abstract: Irregularity indices are usually used for quantitative characterization of the topological structure of nonregular graphs. In numerous applications and problems in material engineering and chemistry, it is useful to be aware that how irregular a… read more here.

Keywords: degree based; chemistry; structure; crystallographic structure ... See more keywords