On the composition dependence of thermodynamic, dynamic and dielectric properties of water-methanol model mixtures. Molecular dynamics simulation results E Galicia-Andrés, H Dominguez, L Pusztai, O Pizio Condensed Matter Physics 18 (4), 43602, 2015 | 46 | 2015 |
Soil organic matter stabilization at molecular scale: The role of metal cations and hydrogen bonds E Galicia-Andrés, Y Escalona, C Oostenbrink, D Tunega, MH Gerzabek Geoderma 401, 115237, 2021 | 42 | 2021 |
Microscopic structure of methanol–water mixtures: Synchrotron X-ray diffraction experiments and molecular dynamics simulations over the entire composition range E Galicia-Andrés, L Pusztai, L Temleitner, O Pizio Journal of Molecular Liquids 209, 586-595, 2015 | 36 | 2015 |
Polarization effects in simulations of kaolinite–water interfaces E Galicia-Andrés, D Petrov, MH Gerzabek, C Oostenbrink, D Tunega Langmuir 35 (47), 15086-15099, 2019 | 25 | 2019 |
A contribution of molecular modeling to supramolecular structures in soil organic matter# MH Gerzabek, AJA Aquino, YIE Balboa, E Galicia‐Andrés, P Grančič, ... Journal of Plant Nutrition and Soil Science 185 (1), 44-59, 2022 | 23 | 2022 |
Temperature dependence of the microscopic structure and density anomaly of the SPC/E and TIP4P-Ew water models. Molecular dynamics simulation results E Galicia-Andrés, H Dominguez, O Pizio arXiv preprint arXiv:1504.01217, 2015 | 21 | 2015 |
On glyphosate–kaolinite surface interactions. A molecular dynamic study E Galicia‐Andrés, D Tunega, MH Gerzabek, C Oostenbrink European Journal of Soil Science 72 (3), 1231-1242, 2021 | 19 | 2021 |
On the adsorption mechanism of humic substances on kaolinite and their microscopic structure E Galicia-Andrés, C Oostenbrink, MH Gerzabek, D Tunega Minerals 11 (10), 1138, 2021 | 13 | 2021 |
Exploring the Macroscopic Properties of Humic Substances Using Modeling and Molecular Simulations Y Escalona, D Petrov, E Galicia-Andrés, C Oostenbrink Agronomy 13 (4), 1044, 2023 | 11 | 2023 |
Modeling of interactions in natural and synthetic organoclays E Galicia-Andrés, P Grančič, MH Gerzabek, C Oostenbrink, D Tunega Computational modeling in clay mineralogy, 211-253, 2021 | 6 | 2021 |
Identification of activating mutations in the transmembrane and extracellular domains of EGFR A Wagner, E Galicia-Andrés, M Teufl, L Gold, C Obinger, P Sykacek, ... Biochemistry 61 (19), 2049-2062, 2022 | 5 | 2022 |
Soil organic matter in molecular simulations MH Gerzabek, D Tunega, E Galicia-Andrés, C Oostenbrink Academic Press, 2023 | 4 | 2023 |
Vapour–liquid interfacial properties of n-alkanes E Galicia-Andres, M Medeiros Journal of Molecular Liquids 248, 253-263, 2017 | 4 | 2017 |
Hydrate Equilibrium Modelling with the Cubic two-state Equation of State E Galicia-Andrés, M Medeiros Journal of the Mexican Chemical Society 60 (4), 226-237, 2016 | 4 | 2016 |
Diluting humic substances in water in molecular dynamics simulations: Are aggregates stable? M Borisover, D Petrov, C Oostenbrink, E Galicia-Andrés Colloids and Surfaces A: Physicochemical and Engineering Aspects 704, 135507, 2025 | | 2025 |
Molecular Dynamics Simulations up to Earth: Modeling of Soil Organic Matter E Galicia–Andrés, Y Escalona, M Gotsmy, C Oostenbrink, D Petrov Elsevier, 2023 | | 2023 |
A molecular dynamic study of Soil Organic Matter stabilization mechanisms E Galicia-Andrés, Y Escalona, P Grančič, C Oostenbrink, D Tunega, ... EGU General Assembly Conference Abstracts, EGU21-2486, 2021 | | 2021 |
On the Adsorption Mechanism of Humic Substances on Kaolinite and Their Microscopic Structure. Minerals 2021, 11, 1138 E Galicia-Andrés, C Oostenbrink, MH Gerzabek, D Tunega s Note: MDPI stays neu-tral with regard to jurisdictional claims in …, 2021 | | 2021 |
Role of organo-mineral aggregates in adsorption, accumulation, and transport of contaminants in soils and sediments E Galicia-Andres, D Tunega Goldschmidt 2025 Conference, 0 | | |
" Watering" of Humic Substances in Molecular Dynamics Simulations: Are the Aggregates Stable? M Borisover, D Petrov, C Oostenbrink, E Galicia-Andrés | | |