Hector Martinez-Seara Monne

All publications

Latest publications

Building Water Models Compatible with Charge Scaling Molecular Dynamics

V. Cruces Chamorro P. Jungwirth H. Martinez-Seara

Journal of Physical Chemistry Letters 15 (10): 2922–2928 (2024)

Hyaluronan-arginine enhanced and dynamic interaction emerges from distinctive molecular signature due to electrostatics and side-chain specificity

M. Riopedre Fernández D. Biriukov M. Dračínský H. Martinez-Seara

Carbohydrate Polymers 325: 121568 (2024)

Hydration of biologically relevant tetramethylammonium cation by neutron scattering and molecular dynamics†

P. E. Mason T. Martinek B. Fábián M. Vazdar P. Jungwirth O. Ticháček E. Duboué-Dijon H. Martinez-Seara

Physical Chemistry Chemical Physics 26 (4): 3208-3218 (2024)

Nonaqueous Ion Pairing Exemplifies the Case for Including Electronic Polarization in Molecular Dynamics Simulations

V. Košťál P. Jungwirth H. Martinez-Seara

Journal of Physical Chemistry Letters 14 (39): 8691–8696 (2023)