| ARCHIE Project title: | 1 TB |
| Project PI: | Department of Physics Rottenrow |
| Department: | 19/10/2021 |
| Address: | Department of Physics, Rottenrow, open-source software, G4 0NG |
| Relevant industrial collaborations: | |
| Existing relevant KTP activities: | |
| Does the PI require to run calculations? | 1 |
| Number of users involved in the project: | 3 years |
| User 1 details: |
Daniel Doveiko, daniel.doveiko.2018@uni.strath.ac.uk, Department of Physics, Univ. of Strathclyde, 01415483059, PhD student |
| Service level requested: | |
| ARCHIE Project description: | 1 TB |
| Potential output of the project: |
The results of simulations will help understanding the onset of the Alzheimer’s disease and support interpretation of the fluorescence-based studies of the real beta-amyloid molecular systems. They will also serve as the preliminary data for the prepared research proposal for EPSRC. A number of publications presenting results of planned simulations are expected. |
| Project start date: | 19/10/2021 |
| Duration of the project: | 3 years |
| Total CPU time required (in hours): | 100000 CPU hours |
| CPU hours required by typical job: | 1 |
| Approximate amount of data created per job (in GB): | |
| Approximate amount of data created per project: | 1 TB |
| Funding Agency Grant Reference No: | to be provided |
| pFact ID: | to be provided |
| RKES ID: | to be provided |
| Software required for the project: | open-source software |
| Software required to be installed for the project: | N/A |
| Experience in using software package 1: | 5 |
| 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: | Molecular Dynamics calculations in NAMD |
| Other training required: | |
| Experience in using HPC: | 5 |