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rocm/5.4.5-singularity-20240124 (rocm-5.4.5-singularity-20240124.eb)

Install with the EasyBuild-user module in partition/container:

module load LUMI partition/container EasyBuild-user
eb rocm-5.4.5-singularity-20240124.eb

The module will be available in all versions of the LUMI stack and in the CrayEnv stack.

To access module help after installation use module spider rocm/5.4.5-singularity-20240124.

EasyConfig:

easyblock = 'MakeCp'

name =          'rocm'
version =       '5.4.5'
versionsuffix = '-singularity-20240124'

local_sif =    'lumi-rocm-rocm-5.4.5-dockerhash-2e8f09a179ec.sif'
#local_docker = 'lumi-rocm-rocm-5.4.5.docker'

homepage = 'https://docs.amd.com/'

whatis = [
    "Description: AMD ROCm is the first open-source software development platform for "
    "HPC/Hyperscale-class GPU computing"
]

description = """
This module provides a container with ROCm %(version)s. 

The module defines a number of environment variables:
*   SIF and SIFROCM: The full path and name of the Singularity SIF file 
    to use with singularity exec etc.
*   SINGULAIRTY_BINDPATH: Mounts the necessary directories from the system,
    including /users, /project, /scratch and /flash so that you should be
    able to use your regular directories in the container.

As this container only contains ROCm and the basic tools to build, it is
of relatively limited use.

Note that there is no guarantee that this container will play nice with
Cray MPICH. Some older versions of Cray MPICH are broken with much newer
versions of ROCm.
"""

toolchain = SYSTEM

sources = [
    {
        'filename':    local_sif,
        'extract_cmd': '/bin/cp %s .'
    },
#    {
#        'filename':    local_docker,
#        'extract_cmd': '/bin/cp %s .'
#    },
]

skipsteps = ['build']

files_to_copy = [
    ([local_sif],    '.'),
#    ([local_docker], 'share/docker-defs/')    
]

local_bin_start_shell="""
#!/bin/bash -e

# Run application
if [[ -f "/.singularity.d/Singularity" ]] 
then
    # In a singularity container, just in case a user would add this to the path.
    exec bash "\$@"
else
    # Not yet in the container
    singularity exec \$SIFROCM bash "\$@"
fi

"""

postinstallcmds = [
    'mkdir -p %(installdir)s/runscripts',         # Even though still empty, it allows uniform mounts for all containers.
    'mkdir -p %(installdir)s/share/docker-defs',  # Simply to have something to test.    
    'mkdir -p %(installdir)s/bin',
    f'cat >%(installdir)s/bin/start-shell <<EOF {local_bin_start_shell}EOF',
    'chmod a+x %(installdir)s/bin/start-shell',
]

sanity_check_paths = {
    # We deliberately don't check for local_sif as the user is allowed to remove that file
    # but may still want to regenerate the module which would then fail in the sanity check.
    'files': ['bin/start-shell'],
    'dirs':  [],
}

modextravars = {
    # SIF variables currently set by a function via modluafooter.
    #'SIF':              '%(installdir)s/' + local_sif,
    #'SIFROCM':         '%(installdir)s/' + local_sif,
    'SINGULARITY_BIND':  '/var/spool/slurmd,/opt/cray,/usr/lib64/libcxi.so.1,/usr/lib64/libjansson.so.4,' +
                         '%(installdir)s/runscripts:/runscripts,' + 
                         '/pfs,/scratch,/projappl,/project,/flash,/appl'
}

modluafooter = f"""
-- Call a routine to set the various environment variables.
create_container_vars( '{local_sif}', 'rocm', '%(installdir)s' )
"""

moduleclass = 'devel'

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