Pavel Jungwirth

Všechny publikace

Nejnovější publikace

Can calmodulin bind to lipids of the cytosolic leaflet of plasma membranes?

F. Scollo C. Tempra H. Evci M. Riopedre Fernández A. Olżyńska M. Javanainen A. Uday M. Cebecauer L. Cwiklik H. Martinez-Seara P. Jungwirth P. Jurkiewicz M. Hof

Open Biology 14 (9): 240067 (2024)

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)

Stability and Reactivity of Aromatic Radical Anions in Solution with Relevance to Birch Reduction

T. Nemirovich B. Young K. Březina P. E. Mason R. Seidel D. Stemer B. Winter P. Jungwirth S. E. Bradforth H. C. Schewe

Journal of the American Chemical Society 146 (12): 8043–8057 (2024)

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)