Radek Crha
Radek Crha MSc
Institute of Molecular Modeling and Simulation
Location Muthgasse 18, 1190 Wien
Email radek.crha@boku.ac.at
Tel: +43 1 47654-89417
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Publications
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Presentations
Year: 2024 - Combining of hybrid QM/MM simulations with machine-learned potentials (Poster)
Autoren: Crha, R
Event: XX Discussions in Structural Molecular Biology and 7th User Meeting of CIISB 2024
Period: 21.03.2024 - 23.03.2024 | Location: Nové Hrady, 539 45 Nové Hrady, Tschechien | Organizer:
Universität České Budějovice
Year: 2024 - Alchemical perturbations within the QM(MLP)/MM simulations (Vortrag)
Autoren: Crha, R
Event: 31st International Biomos Symposium on Biomolecular Simulation 2024
Period: 11.09.2024 - 13.09.2024 | Location: Mutters, 6162 Mutters, Österreich | Location: 6162 Mutters, Österreich | Organizer:
ETH Zürich | Organizer:
Int. Biomolecular Simulation
Year: 2024 - Utilization of machine-learned potentials for enhancing quantum mechanics/molecular mechanics (QM/MM) simulations (Poster)
Autoren: Crha, R
Event: 2024 Workshop on Free Energy Methods in Drug Design
Period: 13.05.2024 - 15.05.2024 | Location: Leiden, Niederlande | Organizer:
Free Energy Methods in Drug Design
Year: 2023 - 14-3-3 dimer vs monomer – (dis)similarities in Tau protein binding (Poster)
Autoren: Crha, R;
Event: EBSA Congress
Period: 31.07.2023 - 04.08.2023 | Location: Stockholm, SWEDEN
Year: 2023 - Training of ML potentials: From system specific models to general ones (Vortrag)
Autoren: Crha, R
Event: BIOMOS Meeting
Period: 05.09.2023 - 07.09.2023 | Location: Mutters, AUSTRIA