Main Investigator: Vojtech Spiwok
Project: Tuning of cyclic peptide integrin ligands by metadynamics
Allocation: 200.000 core hours

 

Main Investigator: Miroslav Urbanek
Project: Time-evolution in two-dimensional optical lattices
Allocation: 800.000 core hours

 

Main Investigator: Ivan Janecek
Project: Time evolution of rare gas clusters ionized to adiabatic electronic states – stage II
Allocation: 150.000 core hours

 

Main Investigator: Jiří Štěpán
Project: Three-dimensional modeling of polarized radiative transfer in the solar chromosphere
Allocation: 1.500.000 core hours

 

Main Investigator: Stanislav Kozmon
Project: Study Of Bacterial Glycosyltransferases Reaction Mechanism By Car-Parrinello Ab Initio Molecular Dynamics, Metadynamics And String Method
Allocation: 2.740.000 core hours

 

Main Investigator: Pavel Plevka
Project: Structural studies of a phage-therapy agent, Staphylococcus aureus phage 812K1-420
Allocation: 1.000.000 core hours

 

Main Investigator: Lubomir Kovacik
Project: Structural analysis of the human mitochondrial Lon protease and its mutant forms
Allocation: 600.000 core hours

 

Main Investigator: Jan Rezac
Project: Simulation of enzyme catalysis involving copper active sites
Allocation: 3.000.000 core hours

 

Main Investigator: Marek Capek
Project: Simulation of clotting coupled with blood flow
Allocation: 500.000 core hours

 

Main Investigator: Thibault Derrien
Project: Quantum-1st-LaP
Allocation: 1.100.000 core hours

 

Main Investigator: Jiří Klimeš
Project: Properties of molecular solids from first principles approaches
Allocation: 800.000 core hours

 

Main Investigator: Petr Parik
Project: PMD_2
Allocation: 70.000 core hours

 

Main Investigator: Stepan Sklenak
Project: Periodic DFT studies of zeolite based catalysts
Allocation: 2.500.000 core hours

 

Main Investigator: Ivan Šimeček
Project: Paralelní výpočty v aplikované krystalografii
Allocation: 40.000 core hours

 

Main Investigator: Richard Wunsch
Project: Origin of the Second Stellar Generation in Globular Clusters
Allocation: 1.000.000 core hours

 

Main Investigator: Pavel Ondracka
Project: Optical properties of HfO2 using many body perturbation theory
Allocation: 100.000 core hours

 

Main Investigator: Vladimira Michalcova
Project: Numerical modeling of load of structures in quasi-static effect of wind
Allocation: 50.000 core hours

 

Main Investigator: Petr Alexa
Project: New phenomenological neutron-proton interaction in odd-odd nuclei
Allocation: 150.000 core hours

 

Main Investigator: Pavel Stasa
Project: Modeling and Simulation of Mine Gases Flow
Allocation: 128.000 core hours

 

Main Investigator: Jiri Jaros
Project: Large scale ultrasound simulations using the k-Wave toolbox
Allocation: 600.000 core hours

 

Main Investigator: Pavel Hobza
Project: In silico drug design
Allocation: 1.000.000 core hours

 

Main Investigator: Jan Kuriplach
Project: Hydrogen-related defects in zinc oxide
Allocation: 150.000 core hours

 

Main Investigator: Jakub Kaminský
Project: Glycoconjugates, their structure and interactions
Allocation: 200.000 core hours

 

Main Investigator: Jakub Velímský
Project: Ensemble modeling of ocean flows, and their magnetic signatures in satellite data
Allocation: 200.000 core hours

 

Main Investigator: Jan Korábečný
Project: Discovery of novel ATR inhibitors as potential anticancer drugs by homology modeling and virtual high-throughput screening
Allocation: 1.500.000 core hours

 

Main Investigator: Marie Behounkova
Project: Convection within planets and satellites II
Allocation: 100.000 core hours

 

Main Investigator: Rafael Dolezal
Project: Computerized drug design of novel glycogen synthase kinase 3 beta inhibitors for Alzheimer’s disease treatment enhanced by structure-based virtual screening and QM/MM calculations
Allocation: 1.500.000 core hours

 

Main Investigator: Jan Hrušák
Project: Computational studies of reaction profiles including excited states of small organic ions relevant for the modeling of Titan´s atmosphere
Allocation: 390.000 core hours

 

Main Investigator: Jozef Hritz
Project: Calculation of absolute binding affinities of selected phosphopeptides to the 14 3 3zeta protein.
Allocation: 1.400.000 core hours

 

Main Investigator: Michal Jakob
Project: Agent-based simulation modelling of on-demand transport systems
Allocation: 140.000 core hours

 

Main Investigator: Petr Vrchota
Project: ACLA
Allocation: 200.000 core hours

 

Main Investigator: Mojmír Šob
Project: Ab initio investigations of advanced materials: applications to properties of interfaces
Allocation: 5.000.000 core hours

 

Main Investigator: Michael Komm
Project: 3D Particle-In-Cell simulations of the Katsumata probe
Allocation: 200.000 core hours

 

Main Investigator: Petr Kovář
Project: 2D structures based on metal phosphonates: relationships between arrangement and properties studied by experimental and calculation methods
Allocation: 96.000 core hours

 

On November 2nd we will participate at the second Day of National Research Infrastructures
On November 2nd we will participate at the second Day of National Research Infrastructures
Invitation to the course Productivity tools for High Performance Computing (2017-11-27 to 2017-11-28)
When: Monday November 27, 2017, 9.30am – Tuesday November 28, 2017, 3.30pm Where: campus VŠB-TUO […]
IT4Innovations Newsletter Q3/2017
IT4Innovations Newsletter Q3/2017
12th Open Access Grant Competition
Announced regularly three times a year for employees of research institutions, scientific and educational organizations. […]
16th PRACE Call for Proposals for Project Access and SHAPE 6th Call for Applications
16th PRACE Project Access The 16th PRACE Call for Proposals for Project Access is open […]
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