Centro de Investigación en Química Biolóxica e Materiais Moleculares (CIQUS)
Centro singular
Universidade Do Porto
Oporto, PortugalPublicacións en colaboración con investigadores/as de Universidade Do Porto (27)
2023
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Antimony Selenide Solar Cells Fabricated by Hybrid Reactive Magnetron Sputtering
Nanomaterials, Vol. 13, Núm. 15
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Giant Polarization in Quasi-Adiabatic Ferroelectric Na+ Electrolyte for Solid-State Energy Harvesting and Storage
Advanced Functional Materials, Vol. 33, Núm. 10
2022
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An integrated protocol to study hydrogen abstraction reactions by atomic hydrogen in flexible molecules: application to butanol isomers
Physical chemistry chemical physics : PCCP, Vol. 24, Núm. 5, pp. 3043-3058
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Corrigendum to “pH-regulated interaction modes between cyanidin-3-glucoside and phenylboronic acid-modified alginate” [Carbohydr. Polym. 280 (2022) 119029] (Carbohydrate Polymers (2022) 280, (S0144861721014168), (10.1016/j.carbpol.2021.119029))
Carbohydrate Polymers
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Effect of gallium doping on structural and transport properties of the topological insulator Bi2Se3grown by molecular beam epitaxy
Journal of Applied Physics, Vol. 132, Núm. 11
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Erratum: Correction: An integrated protocol to study hydrogen abstraction reactions by atomic hydrogen in flexible molecules: application to butanol isomers (Physical chemistry chemical physics : PCCP (2022) 24 5 (3043-3058))
Physical chemistry chemical physics : PCCP
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Molecular Dynamics Simulations of Transmembrane Cyclic Peptide Nanotubes Using Classical Force Fields, Hydrogen Mass Repartitioning, and Hydrogen Isotope Exchange Methods: A Critical Comparison
International Journal of Molecular Sciences, Vol. 23, Núm. 6
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Partition of antimicrobial D-L-α-cyclic peptides into bacterial model membranes
Biochimica et Biophysica Acta - Biomembranes, Vol. 1864, Núm. 1
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SuPepMem: A database of innate immune system peptides and their cell membrane interactions
Computational and Structural Biotechnology Journal, Vol. 20, pp. 874-881
2021
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Dendrimers as Color-Stabilizers of Pyranoanthocyanins: The Dye Concentration Governs the Host-Guest Interaction Mechanisms
ACS Applied Polymer Materials, Vol. 3, Núm. 3, pp. 1457-1464
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Inverse Conformational Selection in Lipid-Protein Binding
Journal of the American Chemical Society, Vol. 143, Núm. 34, pp. 13701-13709
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Macromolecular assembly and membrane activity of antimicrobial D,L-α-Cyclic peptides
Colloids and Surfaces B: Biointerfaces, Vol. 208
2020
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An immersive journey to the molecular structure of SARS-CoV-2: Virtual reality in COVID-19
Computational and Structural Biotechnology Journal, Vol. 18, pp. 2621-2628
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Membrane targeting antimicrobial cyclic peptide nanotubes – an experimental and computational study
Colloids and Surfaces B: Biointerfaces, Vol. 196
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Role of Microsolvation and Quantum Effects in the Accurate Prediction of Kinetic Isotope Effects: The Case of Hydrogen Atom Abstraction in Ethanol by Atomic Hydrogen in Aqueous Solution
Journal of Chemical Theory and Computation, Vol. 16, Núm. 2, pp. 847-859
2019
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Impact of a Water-Soluble Gallic Acid-Based Dendrimer on the Color-Stabilizing Mechanisms of Anthocyanins
Chemistry - A European Journal, Vol. 25, Núm. 50, pp. 11696-11706
2018
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Design and applications of cyclic peptides
Peptide Applications in Biomedicine, Biotechnology and Bioengineering (Elsevier Inc.), pp. 87-129
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GADDLE Maps: General Algorithm for Discrete Object Deformations Based on Local Exchange Maps
Journal of Chemical Theory and Computation, Vol. 14, Núm. 2, pp. 466-478
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Q2DTor: A program to treat torsional anharmonicity through coupled pair torsions in flexible molecules
Computer Physics Communications, Vol. 232, pp. 190-205
2017
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Biodegradable PEG-dendritic block copolymers: Synthesis and biofunctionality assessment as vectors of siRNA
Journal of Materials Chemistry B, Vol. 5, Núm. 25, pp. 4901-4917