Vedoucí skupiny

Pavel Jungwirth

Kontakty

+420 220183184

Skupina

Všechny publikace

Nedávné publikace

Simulation of Raman and Raman optical activity of saccharides in solution

V. Palivec

V. Kopecký

P. Jungwirth P. Bouř J. Kaminský H. Martinez-Seara

Physical Chemistry Chemical Physics 22 (4): 1983-1993 (2020).

Improved Cation Binding to Lipid Bilayers with Negatively Charged POPS by Effective Inclusion of Electronic Polarization

J. Melcr

T. M. Ferreira

P. Jungwirth S. Ollila

Journal of Chemical Theory and Computation 16 (1): 738-748 (2020).

Charge Scaling Manifesto: A Way of Reconciling the Inherently Macroscopic and Microscopic Natures of Molecular Simulations

B. J. Kirby

P. Jungwirth

Journal of Physical Chemistry Letters 10 (23): 7531-7536 (2019).

Quantifying the Strength of a Salt Bridge by Neutron Scattering and Molecular Dynamics

P. E. Mason P. Jungwirth E. Duboué-Dijon

Journal of Physical Chemistry Letters 10 (12): 3254-3259 (2019).