39 results on '"Ales Krenek"'
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2. Property Map Collective Variable as a Useful Tool for a Force Field Correction.
3. Onedata4Sci: Life science data management solution based on Onedata.
4. De-novo Identification of Small Molecules from Their GC-EI-MS Spectra.
5. Similarity Search for an Extreme Application: Experience and Implementation.
6. A survey of the European Open Science Cloud services for expanding the capacity and capabilities of multidisciplinary scientific applications.
7. A survey of the European Open Science Cloud services for expanding the capacity and capabilities of multidisciplinary scientific applications.
8. NEEMP: software for validation, accurate calculation and fast parameterization of EEM charges.
9. Cloudification of scientific experimental data using Onedata
10. Acceleration of Mean Square Distance Calculations with Floating Close Structure in Metadynamics Simulations.
11. Compression of Vector Field Changing in Time.
12. High-quality and universal empirical atomic charges for chemoinformatics applications.
13. Multiple Ligand Trajectory Docking Study - Semiautomatic Analysis of Molecular Dynamics Simulations using EGEE gLite Services.
14. Job Provenance - Insight into Very Large Provenance Datasets.
15. A uniform job monitoring service in multiple job universes.
16. gLite Job Provenance.
17. Haptically Driven Travelling through Conformational Space.
18. Best Practices of User Account Management with Virtual Organization Based Access to Grid.
19. Building 3D State Spaces of Virtual Environments with a TDS-Based Algorithm.
20. Haptic Rendering of Complex Force Fields.
21. Early Experiences with the EGrid Testbed.
22. Special Issue: The First Provenance Challenge.
23. gLite Job Provenance - a job-centric view.
24. The DataGrid Workload Management System: Challenges and Results.
25. Handling Cycles in Conformational Behaviour Visualization.
26. The first deployment of workload management services on the EU DataGrid Testbed: feedback on design and implementation
27. The EU DataGrid Workload Management System: towards the second major release
28. Empirical charges for chemoinformatics applications.
29. Nemesis - a molecular modeling package.
30. Abstract 1685: The EurOPDX Research Infrastructure: Supporting European and worldwide cancer research with patient-derived xenografts
31. Abstract 985: The EurOPDX EDIReX project: Towards a European research infrastructure on patient-derived cancer models
32. The EurOPDX Data Portal: an open platform for patient-derived cancer xenograft data sharing and visualization
33. Collective Variable for Metadynamics Derived From AlphaFold Output
34. Compression of Vector Field Changing in Time
35. Job monitoring on the WLCG scope: Current status and new strategy
36. West-Life: A Virtual Research Environment for structural biology
37. Job Centric Monitoring on the Grid 7 years of experience with L&B and JP services
38. Integrating GRID tools to build a computing resource broker: Activities of DataGrid WP1
39. Multiple ligand trajectory docking study - Semiautomatic analysis of molecular dynamics simulations using EGEE gLite services
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