I.
Introduction
1.
Cloud9
2.
AWS ParallelCluster
3.
Spack
II.
Setup
1.
No-Tears-Cluster
2.
Cloud9
3.
ParallelCluster
III.
Verify
1.
MPI
2.
SLURM
a. Sleep Submission
3.
Spack
IV.
GROMACS 101
1.
Install
2.
Input Data
3.
Slurm Alloc
V.
GROMACS Benchmark
1.
Install via SLURM
2.
Benchmark benchRIB
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Running GROMACS on AWS ParallelCluster
> Introduction
Introduction
In this chapter will introduce the services involved and motivate the outcome.