gromacs benchmark

AMD EPYC 7262 8-Core testing with a GIGABYTE MZ32-AR0-00 v01000100 (R21 BIOS) and NVIDIA GeForce RTX 4090 24GB on Ubuntu 22.04 via the Phoronix Test Suite.

Compare your own system(s) to this result file with the Phoronix Test Suite by running the command: phoronix-test-suite benchmark 2401239-NE-GROMACSBE38
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Result
Identifier
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Performance Per
Dollar
Date
Run
  Test
  Duration
AMD EPYC 7262 8-Core - NVIDIA GeForce RTX 4090 24GB -
January 23
  2 Minutes


gromacs benchmarkOpenBenchmarking.orgPhoronix Test SuiteAMD EPYC 7262 8-Core @ 3.20GHz (8 Cores / 16 Threads)GIGABYTE MZ32-AR0-00 v01000100 (R21 BIOS)AMD Starship/Matisse128GB1000GB Samsung SSD 980 PRO 1TBNVIDIA GeForce RTX 4090 24GBNVIDIA Device 22baDELL U2720Q2 x Intel I350Ubuntu 22.046.5.0-14-generic (x86_64)GNOME Shell 42.9X Server 1.21.1.4NVIDIA 535.154.054.6.0OpenCL 3.0 CUDA 12.2.1481.3.242GCC 11.4.0 + CUDA 11.8ext43840x2160ProcessorMotherboardChipsetMemoryDiskGraphicsAudioMonitorNetworkOSKernelDesktopDisplay ServerDisplay DriverOpenGLOpenCLVulkanCompilerFile-SystemScreen ResolutionGromacs Benchmark PerformanceSystem Logs- Transparent Huge Pages: madvise- --build=x86_64-linux-gnu --disable-vtable-verify --disable-werror --enable-bootstrap --enable-cet --enable-checking=release --enable-clocale=gnu --enable-default-pie --enable-gnu-unique-object --enable-languages=c,ada,c++,go,brig,d,fortran,objc,obj-c++,m2 --enable-libphobos-checking=release --enable-libstdcxx-debug --enable-libstdcxx-time=yes --enable-link-serialization=2 --enable-multiarch --enable-multilib --enable-nls --enable-objc-gc=auto --enable-offload-targets=nvptx-none=/build/gcc-11-XeT9lY/gcc-11-11.4.0/debian/tmp-nvptx/usr,amdgcn-amdhsa=/build/gcc-11-XeT9lY/gcc-11-11.4.0/debian/tmp-gcn/usr --enable-plugin --enable-shared --enable-threads=posix --host=x86_64-linux-gnu --program-prefix=x86_64-linux-gnu- --target=x86_64-linux-gnu --with-abi=m64 --with-arch-32=i686 --with-build-config=bootstrap-lto-lean --with-default-libstdcxx-abi=new --with-gcc-major-version-only --with-multilib-list=m32,m64,mx32 --with-target-system-zlib=auto --with-tune=generic --without-cuda-driver -v - Scaling Governor: acpi-cpufreq ondemand (Boost: Enabled) - CPU Microcode: 0x830107a - gather_data_sampling: Not affected + itlb_multihit: Not affected + l1tf: Not affected + mds: Not affected + meltdown: Not affected + mmio_stale_data: Not affected + retbleed: Mitigation of untrained return thunk; SMT enabled with STIBP protection + spec_rstack_overflow: Mitigation of safe RET + spec_store_bypass: Mitigation of SSB disabled via prctl + spectre_v1: Mitigation of usercopy/swapgs barriers and __user pointer sanitization + spectre_v2: Mitigation of Retpolines IBPB: conditional STIBP: always-on RSB filling PBRSB-eIBRS: Not affected + srbds: Not affected + tsx_async_abort: Not affected

GROMACS

The GROMACS (GROningen MAchine for Chemical Simulations) molecular dynamics package testing with the water_GMX50 data. This test profile allows selecting between CPU and GPU-based GROMACS builds. Learn more via the OpenBenchmarking.org test page.

OpenBenchmarking.orgNs Per Day, More Is BetterGROMACS 2023Implementation: NVIDIA CUDA GPU - Input: water_GMX50_bareAMD EPYC 7262 8-Core - NVIDIA GeForce RTX 4090 24GB -816243240SE +/- 0.08, N = 335.851. (CXX) g++ options: -O3