On glyphosate–kaolinite surface interactions. A molecular dynamic study
Galicia‐Andrés, Edgar, Tunega, Daniel, Gerzabek, Martin H., Oostenbrink, Chris
Published in European journal of soil science (01.05.2021)
Published in European journal of soil science (01.05.2021)
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Journal Article
Identification of Activating Mutations in the Transmembrane and Extracellular Domains of EGFR
Wagner, Anja, Galicia-Andrés, Edgar, Teufl, Magdalena, Gold, Lukas, Obinger, Christian, Sykacek, Peter, Oostenbrink, Chris, Traxlmayr, Michael W.
Published in Biochemistry (Easton) (04.10.2022)
Published in Biochemistry (Easton) (04.10.2022)
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Journal Article
Polarization Effects in Simulations of Kaolinite–Water Interfaces
Galicia-Andrés, Edgar, Petrov, Drazen, Gerzabek, Martin H, Oostenbrink, Chris, Tunega, Daniel
Published in Langmuir (26.11.2019)
Published in Langmuir (26.11.2019)
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Journal Article
A contribution of molecular modeling to supramolecular structures in soil organic matter
Gerzabek, Martin Hubert, Aquino, Adelia Justina Aguiar, Balboa, Yerko Ignacio Escalona, Galicia‐Andrés, Edgar, Grančič, Peter, Oostenbrink, Chris, Petrov, Drazen, Tunega, Daniel
Published in Journal of plant nutrition and soil science (01.02.2022)
Published in Journal of plant nutrition and soil science (01.02.2022)
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Journal Article
Microscopic structure of methanol–water mixtures: Synchrotron X-ray diffraction experiments and molecular dynamics simulations over the entire composition range
Galicia-Andrés, Edgar, Pusztai, László, Temleitner, László, Pizio, Orest
Published in Journal of molecular liquids (01.09.2015)
Published in Journal of molecular liquids (01.09.2015)
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Journal Article
Exploring the Macroscopic Properties of Humic Substances Using Modeling and Molecular Simulations
Escalona, Yerko, Petrov, Drazen, Galicia-Andrés, Edgar, Oostenbrink, Chris
Published in Agronomy (Basel) (01.04.2023)
Published in Agronomy (Basel) (01.04.2023)
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Journal Article
On the Adsorption Mechanism of Humic Substances on Kaolinite and Their Microscopic Structure
Galicia-Andrés, Edgar, Oostenbrink, Chris, Gerzabek, Martin H., Tunega, Daniel
Published in Minerals (Basel) (01.10.2021)
Published in Minerals (Basel) (01.10.2021)
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Journal Article
Soil organic matter stabilization at molecular scale: The role of metal cations and hydrogen bonds
Galicia-Andrés, Edgar, Escalona, Yerko, Oostenbrink, Chris, Tunega, Daniel, Gerzabek, Martin H.
Published in Geoderma (01.11.2021)
Published in Geoderma (01.11.2021)
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Journal Article
Composition dependence of thermodynamic, dynamic and dielectric properties of water–methanol model mixtures. Molecular dynamics simulation results with the OPLS-AA model for methanol
Galicia-Andrés, Edgar, Dominguez, Hector, Pusztai, László, Pizio, Orest
Published in Journal of molecular liquids (01.12.2015)
Published in Journal of molecular liquids (01.12.2015)
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Journal Article
Hydrate Equilibrium Modelling with the Cubic two-state Equation of State
Galicia-Andrés, Edgar, Medeiros, Milton
Published in Journal of the Mexican Chemical Society (01.12.2016)
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Published in Journal of the Mexican Chemical Society (01.12.2016)
Journal Article
Hydrate Equilibrium Modelling with the Cubic two-state Equation of State
Galicia-Andrés, Edgar, Medeiros, Milton
Published in Journal of the Mexican Chemical Society (12.10.2017)
Published in Journal of the Mexican Chemical Society (12.10.2017)
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Journal Article