Química
Departamento
Universidad del País Vasco/Euskal Herriko Unibertsitatea
Lejona, EspañaPublicaciones en colaboración con investigadores/as de Universidad del País Vasco/Euskal Herriko Unibertsitatea (90)
2023
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Aggregation of nucleobases and metabolites: Adenine-theobromine trimers
The Journal of chemical physics, Vol. 158, Núm. 6, pp. 064304
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Conformationally Restricted β-Sheet Breaker Peptides Incorporating Cyclic α-Methylisoserine Sulfamidates
Chemistry - A European Journal, Vol. 29, Núm. 9
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Highly Diastereoselective Multicomponent Synthesis of Spirocyclopropyl Oxindoles Enabled by Rare-Earth Metal Salts
Organic Letters, Vol. 25, Núm. 17, pp. 3001-3006
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Molecular Recognition of Glycan-Bearing Glycomacromolecules Presented at Membrane Surfaces by Lectins: An NMR View
ACS Omega, Vol. 8, Núm. 19, pp. 16883-16895
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NMR Investigation of Protein-Carbohydrate Interactions: The Recognition of Glycans by Galectins Engineered with Fluorotryptophan Residues
Chemistry - A European Journal, Vol. 29, Núm. 5
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Structural insights into Siglec-15 reveal glycosylation dependency for its interaction with T cells through integrin CD11b
Nature Communications, Vol. 14, Núm. 1
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Structures of the Inhibitory Receptor Siglec-8 in Complex with a High-Affinity Sialoside Analogue and a Therapeutic Antibody
JACS Au, Vol. 3, Núm. 1, pp. 204-215
2022
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A structurally unique Fusobacterium nucleatum tannase provides detoxicant activity against gallotannins and pathogen resistance
Microbial Biotechnology, Vol. 15, Núm. 2, pp. 648-667
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Atomic and Specificity Details of Mucin 1 O-Glycosylation Process by Multiple Polypeptide GalNAc-Transferase Isoforms Unveiled by NMR and Molecular Modeling
JACS AU, Vol. 2, Núm. 3, pp. 631-645
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Benchmarking GNOF against FCI in challenging systems in one, two, and three dimensions
Journal of Chemical Physics, Vol. 156, Núm. 21
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Fluorination and deoxygenation as chemical tools to study the conformational preferences of hexopyranoses: a journey from gas phase to solution
75th International Symposium on Molecular Spectroscopy
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Immobilization of Biantennary N-Glycans Leads to Branch Specific Epitope Recognition by LSECtin
ACS Central Science, Vol. 8, Núm. 10, pp. 1415-1423
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Structures of the Inhibitory Receptor Siglec-8 in Complex with a High-Affinity Sialoside Analogue and a Therapeutic Antibody
Journal of the American Chemical Society
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Unveiling the role of pyrylium frameworks on π-stacking interactions: a combined ab initio and experimental study
Physical Chemistry Chemical Physics, Vol. 24, Núm. 4, pp. 1965-1973
2021
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Bacteriophage PRD1 as a nanoscaffold for drug loading
Nanoscale, Vol. 13, Núm. 47, pp. 19875-19883
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Coupling Natural Orbital Functional Theory and Many-Body Perturbation Theory by Using Nondynamically Correlated Canonical Orbitals
Journal of Chemical Theory and Computation, Vol. 17, Núm. 12, pp. 7562-7574
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DoNOF: An open-source implementation of natural-orbital-functional-based methods for quantum chemistry
Computer Physics Communications, Vol. 259
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Exploring Epigenetic Marks by Analysis of Noncovalent Interactions
ChemBioChem, Vol. 22, Núm. 2, pp. 408-415
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Galectin-4 N-Terminal Domain: Binding Preferences Toward A and B Antigens With Different Peripheral Core Presentations
Frontiers in Chemistry, Vol. 9
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Laboratory Observation of, Astrochemical Search for, and Structure of Elusive Erythrulose in the Interstellar Medium
Journal of Physical Chemistry Letters, Vol. 12, Núm. 4, pp. 1352-1359