ID | Software | Module | Toolch | Arch | Data | Speed | CPU | CPUeff | CPUY | GPUY | T | C | N | GPU | NVLink | Site |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
109 | PMEMD.mpi | amber/20.9-20.15 | gomkl | avx2 | 6n4o | 3.66e+00 | EPYC 7532 | 60.6 | 47.92 | 0.0 | 64 | 1 | 1 | 0 | Yes | Narval |
113 | NAMD2.cuda | namd-multicore/2.14 | iimklc | avx2 | 6n4o | 3.47e+00 | Xeon E5-2650 | 100.0 | 0.0 | 0.789 | 1 | 6 | 1 | 1P100-PCIE | No | Cedar |
117 | NAMD2.cuda.ofi | namd-ofi-smp/2.14 | iimklc | avx2 | 6n4o | 3.38e+00 | Xeon E5-2650 | 100.0 | 0.0 | 0.81 | 1 | 6 | 1 | 1P100-PCIE | No | Cedar |
176 | NAMD2.ucx | namd-ucx/2.14 | iimkl | avx2 | 6n4o | 3.10e+00 | Xeon Gold 6238 | 81.8 | 38.92 | 0.0 | 44 | 1 | 1 | 0 | No | Graham |
60 | NAMD2.cuda | namd-multicore/2.14 | iccifortcuda | avx2 | 6n4o | 2.96e+00 | EPYC 7413 | 8.5 | 0.0 | 3.708 | 1 | 24 | 1 | 4A100-SXM4 | Yes | Narval |
1 | NAMD2.omp | namd-multicore/2.14 | iimkl | avx512 | 6n4o | 2.71e+00 | Xeon Gold 6248 | 63.5 | 40.42 | 0.0 | 1 | 40 | 1 | 0 | No | Siku |
11 | PMEMD.mpi | amber/20.9-20.15 | gomkl | avx512 | 6n4o | 2.57e+00 | Xeon Gold 6248 | 64.6 | 42.61 | 0.0 | 40 | 1 | 1 | 0 | No | Siku |
59 | NAMD2.cuda | namd-multicore/2.14 | iccifortcuda | avx2 | 6n4o | 2.42e+00 | EPYC 7413 | 6.9 | 0.0 | 4.531 | 1 | 48 | 1 | 4A100-SXM4 | Yes | Narval |
169 | NAMD2.ucx | namd-ucx/2.14 | iimkl | avx2 | 6n4o | 2.07e+00 | Xeon E5-2683 | 86.2 | 42.35 | 0.0 | 32 | 1 | 1 | 0 | No | Graham |
165 | NAMD2.ucx | namd-ucx/2.14 | iimkl | avx2 | 6n4o | 1.76e+00 | Xeon Platinum 8160 | 45.8 | 74.72 | 0.0 | 48 | 1 | 1 | 0 | No | Cedar |