Publications of Robinson Cortes-Huerto

Baptista, L. A.; Zhao, Y.; Kremer, K.; Mukherji, D.; Cortes-Huerto, R.: Stabilizing α-Helicity of a Polypeptide in Aqueous Urea: Dipole Orientation or Hydrogen Bonding? ACS Macro Letters 12 (7), pp. 841 - 847 (2023)

Forero-Martinez, N. C.; Cortes-Huerto, R.; Ward, L.; Ballone, P.: Water Harvesting by Thermoresponsive Ionic Liquids: A Molecular Dynamics Study of the Water Absorption Kinetics and of the Role of Nanostructuring. Journal of Physical Chemistry B 127 (24), pp. 5494 - 5508 (2023)

Sevilla, M.; Banerjee, A.; Cortes-Huerto, R.: Finite-size excess-entropy scaling for simple liquids. The Journal of Chemical Physics 158 (20), 204502 (2023)

Wadgaonkar, S. P.; Wagner, M.; Baptista, L. A.; Cortes Huerto, R.; Frey, H.; Müller, A. H. E.: Anionic Polymerization of the Terpene-Based Diene beta-Ocimene: Complex Mechanism Due to Stereoisomer Reactivities. Macromolecules 56 (2), pp. 664 - 677 (2023)

Banerjee, A.; Sevilla, M.; Rudzinski, J. F.; Cortes Huerto, R.: Finite-size scaling and thermodynamics of model supercooled liquids: long-range concentration fluctuations and the role of attractive interactions. Soft Matter 18 (12), pp. 2373 - 2382 (2022)

Sevilla, M.; Cortes-Huerto, R.: Connecting density fluctuations and Kirkwood-Buff integrals for finite-size systems. The Journal of Chemical Physics 156 (4), 044502 (2022)

Báez-Cruz, R.; Baptista, L. A.; Ntim, S.; Manidurai, P.; Espinoza, S.; Ramanan, C.; Cortes Huerto, R.; Sulpizi, M.: Role of pH in the synthesis and growth of gold nanoparticles using L-asparagine: a combined experimental and simulation study. Journal of Physics: Condensed Matter 33 (25), 254005 (2021)

Baptista, L. A.; Dutta, R. C.; Sevilla, M.; Heidari, M.; Potestio, R.; Kremer, K.; Cortes Huerto, R.: Density-functional-theory approach to the Hamiltonian adaptive resolution simulation method. Journal of Physics: Condensed Matter 33 (18), 184003 (2021)

Zhao, Y.; Cortes-Huerto, R.; Kremer, K.; Rudzinski, J. F.: Investigating the Conformational Ensembles of Intrinsically Disordered Proteins with a Simple Physics-Based Model. The Journal of Physical Chemistry B 124 (20), pp. 4097 - 4113 (2020)

Heidari, M.; Kremer, K.; Golestanian, R.; Potestio, R.; Cortes Huerto, R.: Open-boundary Hamiltonian adaptive resolution. From grand canonical to non-equilibrium molecular dynamics simulations. The Journal of Chemical Physics 152 (19), 194104 (2020)

Zhao, Y.; Singh, M. K.; Kremer, K.; Cortes-Huerto, R.; Mukherji, D.: Why Do Elastin-Like Polypeptides Possibly Have Different Solvation Behaviors in Water-Ethanol and Water-Urea Mixtures? Macromolecules 53 (6), pp. 2101 - 2110 (2020)

Forero-Martinez, N. C.; Cortes Huerto, R.; Mora Cardozo, J. F.; Ballone, P. A.: Surface of half-neutralized diamine triflate ionic liquids. A molecular dynamics study of structure, thermodynamics, and kinetics of water absorption and evaporation. The Journal of Physical Chemistry B 123 (40), pp. 8457 - 8471 (2019)

Heidari, M.; Cortes Huerto, R.; Potestio, R.; Kremer, K.: Steering a solute between coexisting solvation states: Revisiting nonequilibrium work relations and the calculation of free energy differences. The Journal of Chemical Physics 151 (14), 144105 (2019)

Heidari, M.; Cortes-Huerto, R.; Kremer, K.; Potestio, R.: Concurrent coupling of realistic and ideal models of liquids and solids in Hamiltonian adaptive resolution simulations. European Physical Journal E 41 (5), 64 (2018)

Heidari, M.; Kremer, K.; Cortes-Huerto, R.; Potestio, R.: Spatially Resolved Thermodynamic Integration: An Efficient Method To Compute Chemical Potentials of Dense Fluids. Journal of Chemical Theory and Computation 14 (7), pp. 3409 - 3417 (2018)

Heidari, M.; Kremer, K.; Potestio, R.; Cortes-Huerto, R.: Fluctuations, Finite-Size Effects and the Thermodynamic Limit in Computer Simulations: Revisiting the Spatial Block Analysis Method. Entropy 20 (4), 222 (2018)

Heidari, M.; Kremer, K.; Potestio, R.; Cortes-Huerto, R.: Finite-size integral equations in the theory of liquids and the thermodynamic limit in computer simulations. Molecular Physics 116 (21-22), pp. 3301 - 3310 (2018)

Cortes Huerto, R.; Kremer, K.; Potestio, R.: Communication: Kirkwood-Buff integrals in the thermodynamic limit from small-sized molecular dynamics simulations. The Journal of Chemical Physics 145 (14), 141103 (2016)

Heidari, M.; Cortes-Huerto, R.; Donadio, D.; Potestio, R.: Accurate and general treatment of electrostatic interaction in Hamiltonian adaptive resolution simulations. European Physical Journal - Special Topics 225 (8-9), pp. 1505 - 1526 (2016)

Cortes-Huerto, R.; Goniakowski, J.; Noguera, C.: Role of the environment in the stability of anisotropic gold particles. Physical Chemistry Chemical Physics 17 (9), pp. 6305 - 6313 (2015)