Phil Mason

Všechny publikace

Nejnovější publikace

Charge Scaling Force Field for Biologically Relevant Ions Utilizing a Global Optimization Method

S. Fan P. E. Mason V. Cruces Chamorro B. Shanks H. Martinez-Seara P. Jungwirth

Journal of Chemical Theory and Computation 21 (18): 9023–9034 (2025)

Cation−π Interactions in Biomolecular Contexts by Neutron Scattering and Molecular Dynamics: A Case Study of the Tetramethylammonium Cation

M. Červenka B. Shanks P. E. Mason P. Jungwirth

Journal of Physical Chemistry B 129 (27): 6911–6918 (2025)

Ion pairing in aqueous tetramethylammonium–acetate solutions by neutron scattering and molecular dynamics simulations

N. L. Le Nguyen O. Ticháček P. Jungwirth H. Martinez-Seara P. E. Mason E. Duboué-Dijon

Physical Chemistry Chemical Physics 27 (5): 2553–2562 (2025)

Effective Inclusion of Electronic Polarization Improves the Description of Electrostatic Interactions: The prosECCo75 Biomolecular Force Field

R. Nencini C. Tempra D. Biriukov M. Riopedre Fernández V. Cruces Chamorro J. Polák P. E. Mason D. Ondo J. Heyda O. H. S. Ollila P. Jungwirth M. A. Javanainen H. Martinez-Seara

Journal of Chemical Theory and Computation 20 (17): 7546–7559 (2024)