Pavel Jungwirth

56PUBLICATIONS
125CO-AUTHORS
Mathematical aspects of classical mechanics, quantum mechanics and quantum information theoryColloid and surface chemistryComputational chemistryOptical properties of materialsTheory and design of materials
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (56)

|Feb 19, 2026
Bayesian Learning for Accurate and Robust Biomolecular Force Fields.

Vojtech Kostal, Brennon L Shanks, Pavel Jungwirth

|Nov 17, 2025
Why good quality water models have a surprisingly wide range of dielectric constants.

Víctor Cruces Chamorro, Pavel Jungwirth, Hector Martinez-Seara

|Sep 04, 2025
Charge Scaling Force Field for Biologically Relevant Ions Utilizing a Global Optimization Method.

Shujie Fan, Philip E Mason, Victor Cruces Chamorro

|Jul 16, 2025
NMR-Derived Salt Bridges in Insulin Analogue: Resolving Artifactual Overbinding in Molecular Dynamics via Charge Scaling.

Ngoc Lan Le Nguyen, Jiří Žák, Pavel Jungwirth

|Jun 27, 2025
Cation-π Interactions in Biomolecular Contexts by Neutron Scattering and Molecular Dynamics: A Case Study of the Tetramethylammonium Cation.

Matej Cervenka, Brennon L Shanks, Philip E Mason

|May 09, 2025
Rapid flipping between electrolyte and metallic states in ammonia solutions of alkali metals.

Marco Vitek, Igor Rončević, Ondrej Marsalek

Pageof 10