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2 Complexes sentence examples within density functional theory



Fragmentation and Distortion of Terpyridine-Based Spin-Crossover Complexes on Au(111)


A Theoretical Study on the Stability of PtL2 Complexes of Endohedral Fullerenes: The Influence of Encapsulated Ions, Cage Sizes, and Ligands

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Columnar self-assembly of novel benzylidenehydrazones and their difluoroboron complexes: structure–property correlations


UV and IR Spectroscopy of Transition Metal-Crown Ether Complexes in the Gas Phase: Mn2+(Benzo-15-Crown-5)(H2O)0-2.

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Filling the void: controlled donor-acceptor interaction facilitates the formation of an M-M single bond in the zero oxidation state of M (M = Zn, Cd, Hg).


Steric enforcement of cis-epoxide formation in the radical C-O-coupling reaction by which (S)-2-hydroxypropylphosphonate epoxidase (HppE) produces Fosfomycin.


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Full quantum calculation of the rovibrational states and intensities for a symmetric top-linear molecule dimer: Hamiltonian, basis set, and matrix elements.


Design, synthesis, and biological evaluation of polyphenols with 4,6-diphenylpyrimidin-2-amine derivatives for inhibition of Aurora kinase A

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Mechanism of preferential complex formation by Apoptosis Signal-regulating Kinases


K Atom Promotion of O2 Chemisorption on Au(111) Surface.

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Study of Iron Piperazine-Based Chelators as Potential Siderophore Mimetics


New chromium, molybdenum, and cobalt complexes of the chelating esp ligand

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Catalytic activation of ethylene C-H bonds on uniform d 8 Ir ( I ) and Ni ( II ) cations in zeolites : toward molecular level understanding of ethylene polymerization on heterogeneous catalysts


NO reduction with CO over HY zeolite-supported rhodium dicarbonyl complexes: giving insight into the structure sensitivity

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Palladium complexes bearing κ2-N,N and κ3-N,N,O pendant amine bis(phenolate) ligands


Dinitrogen Functionalization Affording Chromium Hydrazido Complex.

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Effects of Claudin-1 on the Action of Clostridium perfringens Enterotoxin in Caco-2 Cells


Plasmid BMP-2–embedded gelatin sponge as a gene-activated matrix for preosteoblast differentiation


TNRC6 proteins modulate hepatitis C virus replication by spatially regulating the binding of miR-122/Ago2 complexes to viral RNA


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10.1016/j.molcel.2019.03.011

Molecular Mechanisms Directing PRC2 Recruitment and H3K27 Methylation.


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10.1016/j.bioelechem.2018.12.007

Electrochemical, spectroscopic and molecular docking studies on the interaction of calcium channel blockers with dsDNA.



Proton affinity studies of nickel N2S2 complexes and control of aggregation



Structural Features of Mononuclear Chelate Dioxomolybdenum(VI) Complexes with Tetradentate Chelate Ligands—Schiff Bases, Salicylaldehyde Derivatives [MOO2(Lm)] (m = 1−11)



Preferential generation of Ca2+-permeable AMPA receptors by AKAP79-anchored protein kinase C proceeds via GluA1 subunit phosphorylation at Ser-831


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10.1158/1538-7445.AM2019-1457

Abstract 1457: Sustained persistence of IL-2 signaling enhances the antitumor effect of peptide vaccines



Glutathione-glutaredoxin is an efficient electron donor system for mammalian p53R2–R1-dependent ribonucleotide reductase



In situ study of RSK2 kinase activity in a single living cell by combining single molecule spectroscopy with activity-based probes.


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10.1097/j.pain.0000000000001450

Islet-cell autoantigen 69 mediates the antihyperalgesic effects of electroacupuncture on inflammatory pain by regulating spinal glutamate receptor subunit 2 phosphorylation through protein interacting with C-kinase 1 in mice



Hydrodynamic and Electrophoretic Properties of Trastuzumab/HER2 Extracellular Domain Complexes as Revealed by Experimental Techniques and Computational Simulations



A glycine-specific N-degron pathway mediates the quality control of protein N-myristoylation



Bifurcated hydrogen bonds in platinum(II) complexes with phosphinoamine ligands



The effect of locking π-conjugation in organoboron moieties in the structures of luminescent tetracoordinate boron complexes.



Light-Induced Control of the Spin Distribution on Cu–Dithiolene Complexes: A Correlated Ab Initio Study



Role of formyl peptide receptor 2 (FPR2) in the normal brain and in neurological conditions



Understanding the Nature of Weak Interactions between Functionalized Boranes and N2/O2, Promising Functional Groups for Gas Separations.



Theoretical Study of Cationic Alkali Dimers Interacting with He: Li2+-He and Na2+-He van der Waals Complexes.



Structure and function of polycystins: insights into polycystic kidney disease



Polyelectrolyte Complexes between Polycarboxylates and BMP-2 for Enhancing Osteogenic Differentiation: Effect of Chemical Structure of Polycarboxylates


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10.1016/J.MICROMESO.2018.12.027

Biomimetic Cu, Zn and Cu2 complexes inserted in mesoporous silica as catalysts for superoxide dismutation



Stoichiometry and regulation network of Bcl-2 family complexes quantified by live-cell FRET assay



Copper-Catalyzed Ring-Opening Radical Trifluoromethylation of Cycloalkanone Oximes.


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10.1016/j.molcel.2019.06.028

The N-Degron Pathway Mediates ER-phagy.



Titanium and Vanadium Catalysts with 2-Hydroxyphenyloxazoline and Oxazine Ligands for Ethylene-Norbornene (co)Polymerization


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10.3324/haematol.2018.211110

Histone deacetylase inhibition in combination with MEK or BCL-2 inhibition in multiple myeloma



Theoretical Study of the Interaction between Graphyne and cis-PtCl2(NH3)2 Complex



Concentration-induced structural diversity and catalytic activity of BF3/n-BuOH complexes for n-decene polymerization



Strong Luminescent Europium Complexes Induced by the Unprecedented Anti-chelate Effect of Acyl Groups on a N6-Hexadentate Ligand



Hierarchical assembly of the MLL1 core complex within a biomolecular condensate regulates H3K4 methylation


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10.1183/13993003.congress-2019.pa4072

Novel assays to measure forms of interleukin-33 in the circulation and airway mucosa



RuII and IrIII Complexes Containing ADA and DAD Triple Hydrogen Bonding Motifs: Potential Tectons for the Assembly of Functional Materials.



Connecting Main-Group Metals (Al, Ga, In) and Tungsten(0) Carbonyls via the N2S2 Metallo-Ligand Strategy



Receptor tyrosine kinase inhibitor Sunitinib and integrin antagonist peptide HM-3 show similar lipid raft dependent biphasic regulation of tumor angiogenesis and metastasis



Self-sorting processes in a stimuli-responsive supramolecular systems based on cucurbituril, cyclodextrin and bisstyryl guests



Structural basis of Cullin 2 RING E3 ligase regulation by the COP9 signalosome


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10.1016/J.TALANTA.2019.03.080

Evaluation of the binding of natural products with thrombin binding aptamer G-quadruplex using electrospray ionization mass spectrometry and spectroscopic methods.



Electron Transfer on the Donor Side of Manganese-Depleted Photosystem 2



The Bub1-TPR Domain Interacts Directly with Mad3 to Generate Robust Spindle Checkpoint Arrest



Exclusive imidazole ligation to CuO2 and CuIIICuO2 cores.



NDAT suppresses pro-inflammatory gene expression to enhance resveratrol-induced anti-proliferation in oral cancer cells.



Ab initio studies of the ground and first excited states of the Sr-H2 and Yb-H2 complexes.


2 Complexes 2개 단지


2 Complexes 2개 단지
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