Search Results - "BEZRUKOV, Dmitry S"
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Influenza A virus polymerase acidic protein E23G/K substitutions weaken key baloxavir drug-binding contacts with minimal impact on replication and transmission
Published in PLoS pathogens (13-07-2022)“…Baloxavir marboxil (BXM) is approved for treating uncomplicated influenza. The active metabolite baloxavir acid (BXA) inhibits cap-dependent endonuclease…”
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Is Solid Copper Oxalate a Spin Chain or a Mixture of Entangled Spin Pairs?
Published in Journal of physical chemistry. C (08-04-2021)“…Macroscopic assemblies of interacting spins give rise to a broad spectrum of behaviors determined by the spatial arrangement of the magnetic sites and the…”
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Modeling of Manganese Atom and Dimer Isolated in Solid Rare Gases: Structure, Stability, and Effect on Spin Coupling
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (30-03-2017)“…Structures and energies of the trapping sites of manganese atom and dimer in solid Ar, Kr, and Xe are investigated within the classical model, which balances…”
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Antibacterial activity of noscapine analogs
Published in Bioorganic & medicinal chemistry letters (01-07-2021)“…[Display omitted] The antibacterial properties of close noscapine analogs have not been previously reported. We used our pDualrep2 double-reporter High…”
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Synthesis and biological evaluation of Doxorubicin-containing conjugate targeting PSMA
Published in Bioorganic & medicinal chemistry letters (15-05-2019)“…[Display omitted] Prostate-specific membrane antigen (PSMA), also known as glutamate carboxypeptidase II (GCPII), has recently emerged as a prominent biomarker…”
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Synthesis, isomerization and biological activity of novel 2-selenohydantoin derivatives
Published in Bioorganic & medicinal chemistry (15-02-2016)“…[Display omitted] A set of novel selenohydantoins were synthesized via a convenient and versatile approach involving the reaction of isoselenocyanates with…”
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Identification of Novel Antibacterials Using Machine Learning Techniques
Published in Frontiers in pharmacology (27-08-2019)“…Many pharmaceutical companies are avoiding the development of novel antibacterials due to a range of rational reasons and the high risk of failure. However,…”
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Formation of the SiP Radical through Radiative Association
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (29-08-2013)“…Formation of the SiP radical through radiative association of Si(3P) and P(4S) atoms is studied using classical and quantum dynamics. Rate coefficients for…”
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2-Pyrazol-1-yl-thiazole derivatives as novel highly potent antibacterials
Published in Journal of antibiotics (01-11-2019)“…The present report describes our efforts to identify new structural classes of compounds having promising antibacterial activity using previously published…”
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Identification of pyrrolo-pyridine derivatives as novel class of antibacterials
Published in Molecular diversity (01-02-2020)“…A series of 5-oxo-4 H -pyrrolo[3,2-b]pyridine derivatives was identified as novel class of highly potent antibacterial agents during an extensive large-scale…”
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Is solid copper oxalate a spin chain or a mixture of entangled spin pairs?
Published 15-12-2020“…J. Phys. Chem. C 2021 125 (13), 7502-7510 Macroscopic assemblies of interacting spins give rise to a broad spectrum of behaviors determined by the spatial…”
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Reaction Rate Constant for Radiative Association of CF
Published 30-09-2015“…Reaction rate constants and cross sections are computed for the radiative association of carbon cations ($\text{C}^+$) and fluorine atoms ($\text{F}$) in their…”
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