- Heavy Water Models for Classical Molecular Dynamics: Effective Inclusion of Nuclear Quantum Effects2021 | Central Library of Charles University
- Significance Of Nuclear Quantum Effects In Hydrogen Bonded Molecular Chains2021 | Faculty of Mathematics and Physics
- Importance of Nuclear Quantum Effects for Molecular Cocrystals with Short Hydrogen Bonds2022 | Faculty of Science, Central Library of Charles University
- Influence of Intramolecular Charge Transfer and Nuclear Quantum Effects on Intramolecular Hydrogen Bonds in Azopyrimidines2017 | Faculty of Science, Central Library of Charles University
- The hydrogen bond continuum in solid isonicotinic acid2022 | Faculty of Science, Central Library of Charles University
- Effects of Water Deuteration on Thermodynamic and Structural Properties of Proteins and Biomembranes2023 | Central Library of Charles University
- The Quest for Accurate Liquid Water Properties from First Principles2018 | Faculty of Mathematics and Physics
- Developing machine-learned potentials to simultaneously capture the dynamics of excess protons and hydroxide ions in classical and path integral simulations2023 | Faculty of Mathematics and Physics
- Committee neural network potentials control generalization errors and enable active learning2020 | Faculty of Mathematics and Physics
- Persistent Homology Metrics Reveal Quantum Fluctuations and Reactive Atoms in Path Integral Dynamics2021 | Faculty of Mathematics and Physics