forgive me if this thread is considered OT - I think it contains some cross-cultural insights that may be valuable. > Supercomputer parameters info are available at [1] - mixture of Xeon, Xeon > Phi and graphic card cores. Two clusters - Anselm runs RHEL 6, Salomon runs > CentOS 6. It's quite common to find a mixture of node configurations - sometimes within a single cluster, sometimes partitioned. Running a commercial Linux is relatively uncommon, though, since most centres prefer Centos or perhaps Scientific Linux. I haven't found vendor expertise particularly helpful in HPC situations, especially considering that a non-small centre really must maintain its own skilled personnel. > Each node runs on a specific piece of a hardware. If a project is built on a > builder of a different hardware, it is built with different flags and > configuration and the resulting binaries are not properly optimized. Some This matters sometimes. there is a continuum of codes, from not really caring about optimization (by which we mean machine-specific), to those where it makes a lot of difference. A convenient middle is generic apps that select optimized matrix libraries. But for an app which is not vector-friendly, those things don't matter much. > project needs to be built with a proprietary compiler that is not publicly > available. Or given each project needs different version of system libraries The phenomenon is really that various tools/libraries/pipelines come from a variety of different development organizations, which vary in how aggressively they pursue recent versions. The worst are sloppy coders who don't follow standards, so require extremely specific versions of many component packages ("only foo-3.14 is known to work"). That's the main motive for containerization (and to some extent, solutions like environment modules and Nix.) There really is no such thing as "system libraries", when you view software this way... > architecture so it can use all the available instructions not to slow down > the computation. Besides vector length (ie, SSE vs AVX vs AVX-512), there has not been a lot of public, solid demonstrations that compiler- or flag-tweaking matters much. The main scaling dimension is "more nodes", and may be driven by memory footprint as much as CPU speed, so few people sweat the flags to deliver some 7.34% improvement in single-core performance (in my experience.) > - Puppet and Ansible used to deploy clusters (Ansible for disk-free nodes, > Puppetfor nodes with disks). Still, each deployment is unique (e.g. I claim that HPC clusters do not benefit much from these tools: their main value is in handling widely diverse environments that need to change frequently, whereas most HPC clusters are just rack after rack of the same nodes that need to behave the same this year as last year. (My organization uses OneSIS, which permits stateless nodes that run a readonly NFS-root; to upgrade a package, you just "chroot /var/lib/oneSIS/image yum update foo".) > - Experiments with containers as well via Singularity [3] (Docker is not > fully supported on CentOS 6, needs privileged user account) The key point is that Docker is simply inappropriate for HPC, where the norm is a large, shared cluster, and jobs are not anything like Docker's raison d'etre (webservers, redis, etc). In a sense, the normal cluster scheduler is already automating resource management (memory, cores, gpus) and jobs don't need eg exposed IP addresses. Your storage is a quota in a many-PB /project filesystem, not dynamically provisioned S3 buckets. > - HPC community is unfortunately security free, security fix deployment can That's a bit of an overstatement. Most published fixes are simply irrelevant, since very little desktop-ish user-space is even available on compute nodes (firefox, for instance). Kernel updates may be delayed if there are constraints in driver or out-of-tree filesystems. Mitigation (like simply disabling SCTP) is common. But the concern for repeatability makes it unattractive to apply, for instance, glibc updates as well. > - Each assigned set of nodes is expected to be vanilla new. Given it takes This varies between centres - we don't reboot compute nodes voluntarily, and a single node may be shared by jobs from multiple users. You trade increased utilization/efficiency versus some exposure to security and performance interference. It's really a question of how diverse your user-base is... regards, mark hahn.