Andrej Antalík
11PUBLICATIONS
27CO-AUTHORS
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Publications (11)
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|Mar 04, 2026
Atom-centered electric multipole moments dynamically generated from QM/MM MD simulations.Andrea Levy, Andrej Antalík, Jógvan Magnus Haugaard Olsen
|Jun 23, 2025
OpenMM-MiMiC Interface for Efficient and Flexible Multiscale Simulations.Andrea Levy, Andrej Antalík, Jógvan Magnus Haugaard Olsen
|May 06, 2025
Making Puzzle Pieces Fit or Reshaping MiMiC for Multiscale Simulations with CP2K and More.Andrej Antalík, Andrea Levy, Sophia K Johnson
|May 02, 2025
Multiscale Molecular Dynamics Simulations with the MiMiC Framework.Andrea Levy, Andrej Antalík, Jógvan Magnus Haugaard Olsen
|Jul 11, 2024
MiMiC: A high-performance framework for multiscale molecular dynamics simulations.Andrej Antalík, Andrea Levy, Sonata Kvedaravičiūtė
|Sep 27, 2021
Machine Learning-Assisted Selection of Active Spaces for Strongly Correlated Transition Metal Systems.Pavlo Golub, Andrej Antalik, Libor Veis
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Frequent Collaborators
6 joint publications
Libor Veis
5 joint publications
Jógvan Magnus Haugaard Olsen
5 joint publications
Ursula Rothlisberger
5 joint publications
Andrea Levy
4 joint publications
Jiří Brabec
2 joint publications
Sophia K Johnson
1 joint publications
Fabian M Faulstich
1 joint publications
Christian Wäckerlin
1 joint publications
Aurelio Gallardo
1 joint publications
Pavel Jelínek
