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cluster:166 [2018/06/21 13:35] hmeij07 [HPC Users Meeting] |
cluster:166 [2018/06/27 11:51] (current) hmeij07 [Notes] |
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* All Infiniband ports are in use | * All Infiniband ports are in use | ||
+ | ===== Notes ===== | ||
+ | |||
+ | * First make a page comparing CPU vs GPU usage which may influence future purchase [[cluster: | ||
+ | * $100k quote, 3to5 vendors, data points mid-2018 | ||
+ | * One node (or all) should have configured on it: amber, gromacs, laamps, namd, latest version | ||
+ | * Nvidia latest version, optimal configs cpu:gpu ratios | ||
+ | * Amber 1:1 (may be 1:2 in future releases) - amber certified GPU! | ||
+ | * Gromacs 10:1 (could ramp up to claiming all resources per node) | ||
+ | * Namd 13:1 (could ramp up to claiming all resources per node) | ||
+ | * Lammps 2-4:1 | ||
+ | * 128g with enough CPU slots to take over '' | ||
+ | * Anticipated target (also to manage heat exchange) | ||
+ | * 2x10 Xeon CPU (~100gb left) with 2xgtx1080ti GPU (25gb memory required) | ||
+ | * as many as fit budget but but no more than 15 rack wise | ||
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**[[cluster: | **[[cluster: |