Publicacións en colaboración con investigadores/as de Martin Luther University Halle-Wittenberg (17)

2024

  1. Overlay databank unlocks data-driven analyses of biomolecules for all

    Nature communications, Vol. 15, Núm. 1, pp. 1136

2023

  1. Atomistic MD Simulations of n-Alkanes in a Phospholipid Bilayer: CHARMM36 versus Slipids

    Macromolecular Theory and Simulations, Vol. 32, Núm. 3

  2. Rocking motion in solid proteins studied by the 15N proton-decoupled R1ρ relaxometry

    Physical Chemistry Chemical Physics, Vol. 25, Núm. 23, pp. 15885-15896

  3. Simulation data and code used for the publication in Magn. Reson. "Time-domain proton-detected local-field NMR for molecular structure determination in complex lipid membranes"

    Zenodo

  4. Simulation data and code used for the publication in Magn. Reson. "Time-domain proton-detected local-field NMR for molecular structure determination in complex lipid membranes"

    Zenodo

  5. Time-domain proton-detected local-field NMR for molecular structure determination in complex lipid membranes

    Magnetic Resonance, Vol. 4, Núm. 1, pp. 115-127

2022

  1. Filling the Gap with Long n-Alkanes: Incorporation of C20 and C30 into Phospholipid Membranes

    Langmuir, Vol. 38, Núm. 28, pp. 8595-8606

  2. Rotational decoupling between the hydrophilic and hydrophobic regions in lipid membranes

    Biophysical Journal, Vol. 121, Núm. 1, pp. 68-78

2021

  1. Inverse Conformational Selection in Lipid-Protein Binding

    Journal of the American Chemical Society, Vol. 143, Núm. 34, pp. 13701-13709

  2. Using Open Data to Rapidly Benchmark Biomolecular Simulations: Phospholipid Conformational Dynamics

    Journal of Chemical Information and Modeling, Vol. 61, Núm. 2, pp. 938-949

2020

  1. Improved Cation Binding to Lipid Bilayers with Negatively Charged POPS by Effective Inclusion of Electronic Polarization

    Journal of Chemical Theory and Computation, Vol. 16, Núm. 1, pp. 738-748

2019

  1. Headgroup Structure and Cation Binding in Phosphatidylserine Lipid Bilayers

    Journal of Physical Chemistry B, Vol. 123, Núm. 43, pp. 9066-9079

2018

  1. Cholesterol-like effects of a fluorotelomer alcohol incorporated in phospholipid membranes

    Scientific Reports, Vol. 8, Núm. 1

  2. Liquid-liquid phase coexistence in lipid membranes observed by natural abundance 1H-13C solid-state NMR

    Physical Chemistry Chemical Physics, Vol. 20, Núm. 15, pp. 9751-9754

2017

  1. Correction: Effect of cholesterol on the molecular structure and transitions in a clinical-grade lung surfactant extract (Proceedings of the National Academy of Sciences of the United States of America (2017) 114 (E3592-E3601) DOI: 10.1073/pnas.1701239114)

    Proceedings of the National Academy of Sciences of the United States of America

2016

  1. Acyl chain disorder and azelaoyl orientation in lipid membranes containing oxidized lipids

    Langmuir, Vol. 32, Núm. 25, pp. 6524-6533

  2. Applications of solid-state NMR spectroscopy for the study of lipid membranes with polyphilic guest (macro)molecules

    Polymers, Vol. 8, Núm. 12