Difference between revisions of "Computational Chemistry - Enhanced Sampling MD Course at HPC2N (Ume, February 2018)"
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Latest revision as of 08:19, 28 February 2020
| Name | Computational Chemistry - Enhanced Sampling MD Course at HPC2N (Ume, February 2018) |
|---|---|
| Description | Computational Chemistry - Enhanced Sampling MD Course at HPC2N in Umeå |
| Type of event | Course |
| Location | Umeå |
| Start date | 2018-02-26 |
| End date | 2018-02-26 |
Course overview
This one day MD course will look at enhanced sampling, with a focus on NAMD. During the afternoon there will be a hands-on where you get the opportunity to run a NAMD job at HPC2N.
Topics
- Short intro to HPC2N, running a batch job
- Molecular Dynamics Simulations
- Enhanced Sampling (Metadynamics and Accelerated Molecular Dynamics)
- NAMD at HPC2N.
Participations is free. Lunch and coffee will be provided.
Course web page and registration
For more information and registration refer to the Course webpage
