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Multifaceted Computational Modeling in Glycoscience

Chemical reviews, 2022-10, Vol.122 (20), p.15914-15970

2022

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The Mutual Incorporation of Mg2+ and CO32− into Hydroxyapatite: A DFT Study

Materials, 2022-12, Vol.15 (24), p.9046

2022

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Multiscale Molecular Dynamics Studies Reveal Different Modes of Receptor Clustering by Gb3-Binding Lectins

Journal of chemical theory and computation, 2021-04, Vol.17 (4), p.2488-2501

2021

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Interaction-Induced Structural Transformations in Polysaccharide and Protein-Polysaccharide Gels as Functional Basis for Novel Soft-Matter: A Case of Carrageenans

Gels, 2022-05, Vol.8 (5), p.287

2022

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Genetic code expansion in E. coli enables production of a functional ‘ready-to-click’ T cell receptor-specific scFv

New biotechnology, 2023-09, Vol.76, p.127-137

2023

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Svx Peptidases of Phytopathogenic Pectolytic Bacteria: Structural, Catalytic and Phytoimmune Properties

International journal of molecular sciences, 2024-01, Vol.25 (2), p.756

2024

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Sulfated Polysaccharides as a Fighter with Protein Non-Physiological Aggregation: The Role of Polysaccharide Flexibility and Charge Density

International journal of molecular sciences, 2023-11, Vol.24 (22), p.16223

2023

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Structure-Functional Characteristics of the Svx Protein—The Virulence Factor of the Phytopathogenic Bacterium Pectobacterium atrosepticum

International journal of molecular sciences, 2022-07, Vol.23 (13), p.6914

2022

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Regulation of Intersubunit Interactions in Homotetramer of Glyceraldehyde-3-Phosphate Dehydrogenases upon Its Immobilization in Protein-Kappa-Carrageenan Gels

Polymers, 2023-01, Vol.15 (3), p.676

2023

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Influence of Al on the Structure and in Vitro Behavior of Hydroxyapatite Nanopowders

The journal of physical chemistry. B, 2019-10, Vol.123 (43), p.9143-9154

2019

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Spatial structures of rhamnogalacturonan I in gel and colloidal solution identified by 1D and 2D-FTIR spectroscopy

Carbohydrate polymers, 2018-07, Vol.192, p.231-239

2018

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The In Silico Characterization of Monocotyledonous α-l-Arabinofuranosidases on the Example of Maize

Life (Basel, Switzerland), 2023-01, Vol.13 (2), p.266

2023

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Fibril fragments from the amyloid core of lysozyme: An accelerated molecular dynamics study

Journal of molecular graphics & modelling, 2021-07, Vol.106, p.107917-107917, Article 107917

2021

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κ-Carrageenan Hydrogel as a Matrix for Therapeutic Enzyme Immobilization

Polymers, 2022-09, Vol.14 (19), p.4071

2022

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Iron-Doped Mesoporous Powders of Hydroxyapatite as Molybdenum-Impregnated Catalysts for Deep Oxidative Desulfurization of Model Fuel: Synthesis and Experimental and Theoretical Studies

Journal of physical chemistry. C, 2021-06, Vol.125 (21), p.11604-11619

2021

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Mechanism of activation of plant monogalactosyldiacylglycerol synthase 1 (MGD1) by phosphatidylglycerol

Glycobiology (Oxford), 2020-05, Vol.30 (6), p.396-406

2020

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Peculiarities of charge compensation in lithium-doped hydroxyapatite

Heliyon, 2024-02, Vol.10 (4), p.e25291-e25291, Article e25291

2024

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The Ability of Some Polysaccharides to Disaggregate Lysozyme Amyloid Fibrils and Renature the Protein

Pharmaceutics, 2023-02, Vol.15 (2), p.624

2023

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Mesoporous Iron(III)-Doped Hydroxyapatite Nanopowders Obtained via Iron Oxalate

Nanomaterials (Basel, Switzerland), 2021-03, Vol.11 (3), p.811

2021

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GAG-DB, the New Interface of the Three-Dimensional Landscape of Glycosaminoglycans

Biomolecules (Basel, Switzerland), 2020-12, Vol.10 (12), p.1660

2020

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Dimeric Lectin Chimeras as Novel Candidates for Gb3-Mediated Transcytotic Drug Delivery through Cellular Barriers

Pharmaceutics, 2023-01, Vol.15 (1), p.225

2023

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Incorporation of Iron(II) and (III) in Hydroxyapatite—A Theoretical Study

Crystals (Basel), 2021-10, Vol.11 (10), p.1219

2021

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The Mutual Incorporation of Mg 2+ and CO 3 2- into Hydroxyapatite: A DFT Study

Materials, 2022-12, Vol.15 (24)

2022

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The Mutual Incorporation of Mg[sup.2+] and CO[sub.3][sup.2−] into Hydroxyapatite: A DFT Study

Materials, 2022-12, Vol.15 (24)

2022

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Effect of organic molecules on hydrolysis of peptide bond: A DFT study

Chemical physics, 2013-03, Vol.415, p.282-290

2013

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Multifaceted Computational Modeling in Glycoscience

The Mutual Incorporation of Mg2+ and CO32− into Hydroxyapatite: A DFT Study

Multiscale Molecular Dynamics Studies Reveal Different Modes of Receptor Clustering by Gb3-Binding Lectins

Interaction-Induced Structural Transformations in Polysaccharide and Protein-Polysaccharide Gels as Functional Basis for Novel Soft-Matter: A Case of Carrageenans

Genetic code expansion in E. coli enables production of a functional ‘ready-to-click’ T cell receptor-specific scFv

Svx Peptidases of Phytopathogenic Pectolytic Bacteria: Structural, Catalytic and Phytoimmune Properties

Sulfated Polysaccharides as a Fighter with Protein Non-Physiological Aggregation: The Role of Polysaccharide Flexibility and Charge Density

Structure-Functional Characteristics of the Svx Protein—The Virulence Factor of the Phytopathogenic Bacterium Pectobacterium atrosepticum

Regulation of Intersubunit Interactions in Homotetramer of Glyceraldehyde-3-Phosphate Dehydrogenases upon Its Immobilization in Protein-Kappa-Carrageenan Gels

Influence of Al on the Structure and in Vitro Behavior of Hydroxyapatite Nanopowders

Spatial structures of rhamnogalacturonan I in gel and colloidal solution identified by 1D and 2D-FTIR spectroscopy

The In Silico Characterization of Monocotyledonous α-l-Arabinofuranosidases on the Example of Maize

Fibril fragments from the amyloid core of lysozyme: An accelerated molecular dynamics study

κ-Carrageenan Hydrogel as a Matrix for Therapeutic Enzyme Immobilization

Iron-Doped Mesoporous Powders of Hydroxyapatite as Molybdenum-Impregnated Catalysts for Deep Oxidative Desulfurization of Model Fuel: Synthesis and Experimental and Theoretical Studies

Mechanism of activation of plant monogalactosyldiacylglycerol synthase 1 (MGD1) by phosphatidylglycerol

Peculiarities of charge compensation in lithium-doped hydroxyapatite

The Ability of Some Polysaccharides to Disaggregate Lysozyme Amyloid Fibrils and Renature the Protein

Mesoporous Iron(III)-Doped Hydroxyapatite Nanopowders Obtained via Iron Oxalate

GAG-DB, the New Interface of the Three-Dimensional Landscape of Glycosaminoglycans

Dimeric Lectin Chimeras as Novel Candidates for Gb3-Mediated Transcytotic Drug Delivery through Cellular Barriers

Incorporation of Iron(II) and (III) in Hydroxyapatite—A Theoretical Study

The Mutual Incorporation of Mg 2+ and CO 3 2- into Hydroxyapatite: A DFT Study

The Mutual Incorporation of Mg[sup.2+] and CO[sub.3][sup.2−] into Hydroxyapatite: A DFT Study

Effect of organic molecules on hydrolysis of peptide bond: A DFT study

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