Computational Chemistry - Enhanced Sampling MD Course at HPC2N (Ume, February 2018)
From SNIC Documentation
|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|
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.
- 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