| ARCHIE Project title: | 300 |
| Project PI: | James Weir |
| Department: | 25 November 2013 |
| Address: | James Weir, , open-source software, G1 1XJ |
| Relevant industrial collaborations: | |
| Existing relevant KTP activities: | |
| Does the PI require to run calculations? | 1 |
| Number of users involved in the project: | 12 months |
| User 1 details: |
Onorio Mancini |
| Service level requested: | |
| ARCHIE Project description: | 300 |
| Potential output of the project: |
The work performed will lead to publications and will form part of Onorio’s thesis. The results will also be used in funding proposals to Research Councils, including requests for further use of Archie-West. |
| Project start date: | 25 November 2013 |
| Duration of the project: | 12 months |
| Total CPU time required (in hours): | 100,000 |
| CPU hours required by typical job: | 1 |
| Approximate amount of data created per job (in GB): | |
| Approximate amount of data created per project: | 300 |
| Funding Agency Grant Reference No: | |
| pFact ID: | |
| RKES ID: | |
| Software required for the project: | open-source software |
| Software required to be installed for the project: | N/A |
| Experience in using software package 1: | |
| Software required to be installed for the project: | |
| Experience in using software package 2: | 1 |
| Software required to be installed for the project: | |
| Experience in using software package 3: | 1 |
| Training required: | Basic Linux, Basic of using HPC, Molecular Dynamics calculations in NAMD, Visualisation in VMD |
| Other training required: | |
| Experience in using HPC: | 1 |