Ángel Piñeiro

Associate Professor

Universidade de Santiago de Compostela

Spain

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Articles (19)

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2024

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2020

Collaborators (8)

Matti Javanainen

University of Helsinki

FINLAND

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Jesper Jonasson Madsen

Assistant professor (research track)

University of South Florida

UNITED STATES

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Tiago M. Ferreira

GERMANY

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Paula Antelo-Riveiro

Universidade de Santiago de Compostela

SPAIN

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Juan Granja

Professor

Universidade de Santiago de Compostela

SPAIN

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Alfredo Amigo

Profesor titular

Universidade de Santiago de Compostela

SPAIN

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Siewert J. Marrink

University of Groningen

NETHERLANDS

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Pedro Rodriguez-Dafonte

Profesor Titular de Universidad

Universidade de Santiago de Compostela

SPAIN

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Ángel Piñeiro

Research Interests

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Articles (19)

Cyclodextrins: Establishing building blocks for AI-driven drug design by determining affinity constants in silico

Simulating Bacterial Membrane Models at the Atomistic Level: A Force Field Comparison

Addressing the complexities in measuring cyclodextrin-sterol binding constants: A multidimensional study

Molecular insights into the effects of focused ultrasound mechanotherapy on lipid bilayers

Reversing atherosclerosis by the specific removal of oxidized cholesterol with cyclodextrin dimer

Uncovering the mechanisms of cyclic peptide self-assembly in membranes with the chirality-aware MA(R/S)TINI forcefield

The Role of AI in Drug Discovery: Challenges, Opportunities, and Strategies

Unsupervised bubble calorimetry analysis: Surface tension from isothermal titration calorimetry

Remdesivir interactions with sulphobutylether-β-cyclodextrins: A case study using selected substitution patterns

Not so rigid capsids based on cyclodextrin complexes: Keys to design

Molecular Dynamics Simulations of Transmembrane Cyclic Peptide Nanotubes Using Classical Force Fields, Hydrogen Mass Repartitioning, and Hydrogen Isotope Exchange Methods: A Critical Comparison

Inverse Conformational Selection in Lipid–Protein Binding

Transmembrane Self-Assembled Cyclic Peptide Nanotubes Based on α‐Residues and Cyclic δ‐Amino Acids: A Computational Study

Aggregation versus inclusion complexes to solubilize drugs with cyclodextrins. A case study using sulphobutylether-β-cyclodextrins and remdesivir

Simple ApproximaTion for Aggregation Number Determination by Isothermal Titration Calorimetry: STAND-ITC

Cyclodextrin dimers: A versatile approach to optimizing encapsulation and their application to therapeutic extraction of toxic oxysterols

Fluid interface calorimetry

Delving Into the Origin of Destructive Inflammation in COVID-19: A Betrayal of Natural Host Defense Peptides?

The Lord of the NanoRings: Cyclodextrins and the battle against SARS-CoV-2

Collaborators (8)

Matti Javanainen

Jesper Jonasson Madsen

Tiago M. Ferreira

Paula Antelo-Riveiro

Juan Granja

Alfredo Amigo

Siewert J. Marrink

Pedro Rodriguez-Dafonte

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