Organizer: BioExcel

Start: Friday, 04 June 2021 @ 13:00

End: Friday, 11 June 2021 @ 16:10

Timezone: CEST

Scientific topic: Molecular modelling, Molecular dynamics

Target audience:
  • Early Career Researcher
Description:

The summer school will include lectures and hands-on sessions on the following topics:
- Molecular Dynamics simulations
- Biomolecular Docking
- Free energy calculations
- Advanced sampling methods (Metadynamics)
- BioExcel Building Blocks (BioBB)
- Quantum mechanics/molecular mechanics (QM/MM)

During the hands-on computer practicals you will make use of the BioExcel flagship software and tools: e.g. GROMACS, HADDOCK, PMX, BioBB, and CP2K. The trainers, developers and/or experts in the use of the software, will provide guidance and support.

Audience and Prerequisites

The summer school is intended for researchers (primarily PhD and post-docs) using or planning to use biomolecular modeling and simulation in their everyday research. Familiarity with Linux and basic knowledge of molecular modelling software is a requirement.

Event type:
  • Workshops and courses

Capacity: 30

Keywords: biomolecular simulations, molecular dynamics, Molecular docking, free energy, QM/MM

BioExcel Summer School on Biomolecular Simulations https://tess.elixir-europe.org/events/bioexcel-summer-school-on-biomolecular-simulations-a8333d9f-0f1c-440b-bede-bf6320971623 The summer school will include lectures and hands-on sessions on the following topics: - Molecular Dynamics simulations - Biomolecular Docking - Free energy calculations - Advanced sampling methods (Metadynamics) - BioExcel Building Blocks (BioBB) - Quantum mechanics/molecular mechanics (QM/MM) During the hands-on computer practicals you will make use of the BioExcel flagship software and tools: e.g. GROMACS, HADDOCK, PMX, BioBB, and CP2K. The trainers, developers and/or experts in the use of the software, will provide guidance and support. **Audience and Prerequisites** The summer school is intended for researchers (primarily PhD and post-docs) using or planning to use biomolecular modeling and simulation in their everyday research. Familiarity with Linux and basic knowledge of molecular modelling software is a requirement. 2021-06-04 13:00:00 UTC 2021-06-11 16:10:00 UTC BioExcel Molecular modelling Molecular dynamics [] [] Early Career Researcher 30 workshops_and_courses [] biomolecular simulationsmolecular dynamicsMolecular dockingfree energyQM/MM