Mgr. Aleš Křenek, Ph.D.
Research and development staff II, Core Facilities
Office: G308
Šumavská 416/15
602 00 Brno
Phone: | +420 549 49 4212 |
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E‑mail: |
social and academic networks: |
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Total number of publications: 66
2022
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Property Map Collective Variable as a Useful Tool for a Force Field Correction
Journal of Chemical Information and Modeling, year: 2022, volume: 62, edition: 3, DOI
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The EurOPDX Data Portal: an open platform for patient-derived cancer xenograft data sharing and visualization
BMC Genomics, year: 2022, volume: 23, edition: 1, DOI
2021
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Complex simulation workflows in containerized high-performance environment
Proc. ESM 2021, year: 2021
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Similarity Search for an Extreme Application: Experience and Implementation
Similarity Search and Applications: 14th International Conference, SISAP 2021, Dortmund, Germany, September 29 - October 1, 2021, Proceedings, year: 2021
2020
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Exploring Protein Folding Space with Neural Network Guided Simulations
MODELLING AND SIMULATION 2020, year: 2020
2019
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West-Life: A Virtual Research Environment for structural biology
Journal of Structural Biology: X, year: 2019, volume: 1, edition: January - March 2019, DOI
2018
2017
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Identification of "BRAF-Positive" Cases Based on Whole-Slide Image Analysis
Biomed Research International, year: 2017, volume: Neuveden, edition: April, DOI
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Reducing the number of mean-square deviation calculations with floating close structure in metadynamics
Journal of Chemical Physics, year: 2017, volume: 146, edition: 11, DOI
2016
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Accelerated RMSD Calculation for Molecular Metadynamics
Proceedings of the 2016 European Simulation and Modelling Conference, year: 2016