Articles with "flexible ligand" as a keyword



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Flexible-Ligand-Based Self-adaptive Metal-Organic Material for Supramolecular Selective Recognition of Similar Natural Molecules.

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Published in 2019 at "Inorganic chemistry"

DOI: 10.1021/acs.inorgchem.9b00148

Abstract: A flexible-ligand-based metal-organic cage containing functional amide and secondary amino groups as guest-interacted sites has been synthesized. The synergistic effect between the size-defined cavity and self-adaptive backbone endows the cage excellent properties for the selective… read more here.

Keywords: ligand based; selective recognition; self adaptive; metal organic ... See more keywords
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Flexible Ligand in a Molecular Cu Electrocatalyst Unfurls Bidirectional O2/H2O Conversion in Water

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Published in 2021 at "ACS Catalysis"

DOI: 10.1021/acscatal.1c01542

Abstract: The development of a bidirectional catalyst for oxygen reduction and water oxidation is the key to establishing sustainable energy transduction from renewable resources. We report a stable homogene... read more here.

Keywords: ligand molecular; water; electrocatalyst unfurls; unfurls bidirectional ... See more keywords
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Reactive Dicarbon as a Flexible Ligand for Transition-Metal Coordination and Catalysis.

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Published in 2022 at "Journal of the American Chemical Society"

DOI: 10.1021/jacs.2c05486

Abstract: Dicarbon is a reactive carbon allotrope that naturally exists only in the high-temperature medium of stellar space. We report the successful preparation of a series of bottleable phosphine-stabilized dicarbon (PDC) molecules. We explore the use… read more here.

Keywords: pdc; flexible ligand; dicarbon flexible; reactive dicarbon ... See more keywords
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[(Flu)-(CH2)2-(NHC)-CH2-(NHC)-(CH2)2-(Flu)]2-: an 'all-organic' hybrid and flexible ligand that enwraps a Ca2+ pseudo-tetrahedrally.

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Published in 2022 at "Chemical communications"

DOI: 10.1039/d2cc04700d

Abstract: A conformationally flexible ligand, [(Flu)-(CH2)2-(NHC)-CH2-(NHC)-(CH2)2-(Flu)]2- (L), that offers four sequential organic donor modules and enwraps a Ca2+ pseudo-tetrahedrally in a twisted 'S'-shape is devised. The [(L)Ca] synthesis is intriguingly stepwise involving the intermediate [(LH)Ca(HMDS)], whereas… read more here.

Keywords: ch2 nhc; flexible ligand; flu ch2; ch2 ... See more keywords
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Diversity-guided Lamarckian random drift particle swarm optimization for flexible ligand docking

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Published in 2020 at "BMC Bioinformatics"

DOI: 10.1186/s12859-020-03630-2

Abstract: Background Protein-ligand docking has emerged as a particularly important tool in drug design and development, and flexible ligand docking is a widely used method for docking simulations. Many docking software packages can simulate flexible ligand… read more here.

Keywords: flexible ligand; swarm optimization; particle swarm; ligand ... See more keywords