Radek Crha

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 (Talk)

  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 (Talk)

  Autoren: Crha, R

  Event: BIOMOS Meeting

  Period: 05.09.2023 - 07.09.2023  | Location: Mutters, AUSTRIA