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| Metric | r0 | r1 | r2 | r3 | r4 | r5 |
|---|
| Total Time (s) | 23.14 | 22.28 | 21.10 | 21.68 | 21.87 | 21.19 |
| Max (Thread Active Time) (s) | 23.09 | 22.24 | 21.06 | 21.39 | 21.52 | 20.84 |
| Average Active Time (s) | 23.08 | 22.22 | 21.05 | 20.70 | 20.90 | 20.25 |
| Activity Ratio (%) | 99.9 | 99.9 | 99.9 | 95.7 | 95.8 | 95.8 |
| Average number of active threads | 63.827 | 63.829 | 63.824 | 61.132 | 61.179 | 61.160 |
| Affinity Stability (%) | 100.0 | 100.0 | 100.0 | 99.9 | 99.9 | 99.9 |
| Time in analyzed loops (%) | 41.0 | 39.4 | 36.9 | 86.4 | 86.6 | 86.6 |
| Time in analyzed innermost loops (%) | 4.88 | 5.00 | 5.26 | 47.2 | 46.8 | 49.4 |
| Time in user code (%) | 83.2 | 83.1 | 83.1 | 86.4 | 86.6 | 86.6 |
| Compilation Options Score (%) | 62.5 | 75.0 | 75.0 | 100 | 100 | 100 |
| Array Access Efficiency (%) | 62.5 | 62.5 | 62.5 | 99.4 | 99.4 | 99.5 |
|
| Potential Speedups |  |
| Perfect Flow Complexity | 1.00 | 1.00 | 1.00 | 1.00 | 1.00 | 1.00 |
| Perfect OpenMP/MPI/Pthread/TBB | 1.04 | 1.04 | 1.05 | 1.04 | 1.03 | 1.04 |
| Perfect OpenMP/MPI/Pthread/TBB + Perfect Load Distribution | 1.20 | 1.20 | 1.20 | 1.19 | 1.18 | 1.18 |
| No Scalar Integer | Potential Speedup | 1.44 | 1.40 | 1.33 | 1.38 | 1.39 | 1.15 |
| Nb Loops to get 80% | 1 | 1 | 1 | 1 | 1 | 2 |
| FP Vectorised | Potential Speedup | 1.26 | 1.25 | 1.20 | 1.99 | 1.99 | 1.96 |
| Nb Loops to get 80% | 1 | 1 | 2 | 7 | 7 | 7 |
| Fully Vectorised | Potential Speedup | 1.28 | 1.26 | 1.32 | 2.21 | 2.22 | 2.61 |
| Nb Loops to get 80% | 2 | 2 | 2 | 7 | 7 | 7 |
| Only FP Arithmetic | Potential Speedup | 1.01 | 1.01 | 1.12 | 1.01 | 1.01 | 1.12 |
| Nb Loops to get 80% | 3 | 3 | 1 | 3 | 3 | 1 |
| Source Object | Issue |
| ▼md-gcc-O2– | |
| ▼vector.tcc– | |
| ○ | -O3 or -Ofast is missing. |
| ○ | -mcpu=native is missing. |
| ▼simulation.cpp– | |
| ○ | -O3 or -Ofast is missing. |
| ○ | -mcpu=native is missing. |
| ▼particle.cpp– | |
| ○ | -O3 or -Ofast is missing. |
| ○ | -mcpu=native is missing. |
| Source Object | Issue |
| ▼md-gcc-O3– | |
| ▼simulation.cpp– | |
| ○ | -mcpu=native is missing. |
| Source Object | Issue |
| ▼md-gcc-Ofast– | |
| ▼simulation.cpp– | |
| ○ | -mcpu=native is missing. |
| Source Object | Issue |
| ▼md-acfl-O2– | |
| ▼simulation.cpp– | |
| ○ | |
| Source Object | Issue |
| ▼md-acfl-O3– | |
| ▼simulation.cpp– | |
| ○ | |
| Source Object | Issue |
| ▼md-acfl-Ofast– | |
| ▼simulation.cpp– | |
| ○ | |
| r0 | r1 | r2 | r3 | r4 | r5 |
| Experiment Name | MD Scalability Graviton 3 2-64 threads runs | Version : gcc-O2 | MD Scalability Graviton 3 2-64 threads runs | Version : gcc-O3 | MD Scalability Graviton 3 2-64 threads runs | Version : gcc-Ofast | MD Scalability Graviton 3 2-64 threads runs | Version : acfl-O2 | MD Scalability Graviton 3 2-64 threads runs | Version : acfl-O3 | MD Scalability Graviton 3 2-64 threads runs | Version : acfl-Ofast |
| Application | ./bin/md-gcc-O2 | ./bin/md-gcc-O3 | ./bin/md-gcc-Ofast | ./bin/md-acfl-O2 | ./bin/md-acfl-O3 | ./bin/md-acfl-Ofast |
| Timestamp | 2025-08-20 11:43:40 | 2025-08-20 12:02:39 | 2025-08-20 12:20:53 | 2025-08-20 12:37:59 | 2025-08-20 12:55:41 | 2025-08-20 13:13:35 |
| Experiment Type | OpenMP; | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Machine | ip-172-31-18-66 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Architecture | aarch64 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Micro Architecture | ARM_NEOVERSE_V1 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Model Name | | | | | | |
| Cache Size | | | | | | |
| Number of Cores | | | | | | |
| Maximal Frequency | 0 GHz | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| OS Version | Linux 6.14.0-1010-aws #10~24.04.1-Ubuntu SMP Fri Jul 18 20:39:43 UTC 2025 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Architecture used during static analysis | aarch64 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Micro Architecture used during static analysis | ARM_NEOVERSE_V1 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Compilation Options |
md-gcc-O2: GNU C++17 14.2.0 -mlittle-endian -mabi=lp64 -g -O2 -std=c++17 -fopenmp -funroll-loops | md-gcc-O3: GNU C++17 14.2.0 -mlittle-endian -mabi=lp64 -g -O3 -std=c++17 -fopenmp -funroll-loops | md-gcc-Ofast: GNU C++17 14.2.0 -mlittle-endian -mabi=lp64 -g -Ofast -std=c++17 -fopenmp -funroll-loops | md-acfl-O2: Arm C/C++/Fortran Compiler version 24.10.1 (build number 4) (based on LLVM 19.1.0) /opt/arm/arm-linux-compiler-24.10.1_Ubuntu-20.04/llvm-bin/clang-19 --driver-mode=g++ -std=c++17 -fopenmp -D USE_OPENMP -Wall -Werror -Wextra -O2 -grecord-command-line -funroll-loops -g -I include -march=native -mcpu=native -c simulation.cpp -o simulation.o Arm C/C++/Fortran Compiler version 24.10.1 (build number 4) (based on LLVM 19.1.0) /opt/arm/arm-linux-compiler-24.10.1_Ubuntu-20.04/llvm-bin/clang-19 --driver-mode=g++ -std=c++17 -fopenmp -D USE_OPENMP -Wall -Werror -Wextra -O2 -grecord-command-line -funroll-loops -g -I include -march=native -mcpu=native -c main.cpp -o main.o | md-acfl-O3: Arm C/C++/Fortran Compiler version 24.10.1 (build number 4) (based on LLVM 19.1.0) /opt/arm/arm-linux-compiler-24.10.1_Ubuntu-20.04/llvm-bin/clang-19 --driver-mode=g++ -std=c++17 -fopenmp -D USE_OPENMP -Wall -Werror -Wextra -O3 -grecord-command-line -funroll-loops -g -I include -march=native -mcpu=native -c simulation.cpp -o simulation.o Arm C/C++/Fortran Compiler version 24.10.1 (build number 4) (based on LLVM 19.1.0) /opt/arm/arm-linux-compiler-24.10.1_Ubuntu-20.04/llvm-bin/clang-19 --driver-mode=g++ -std=c++17 -fopenmp -D USE_OPENMP -Wall -Werror -Wextra -O3 -grecord-command-line -funroll-loops -g -I include -march=native -mcpu=native -c main.cpp -o main.o | md-acfl-Ofast: Arm C/C++/Fortran Compiler version 24.10.1 (build number 4) (based on LLVM 19.1.0) /opt/arm/arm-linux-compiler-24.10.1_Ubuntu-20.04/llvm-bin/clang-19 --driver-mode=g++ -std=c++17 -fopenmp -D USE_OPENMP -Wall -Werror -Wextra -Ofast -grecord-command-line -funroll-loops -g -I include -march=native -mcpu=native -c simulation.cpp -o simulation.o GNU C17 14.2.0 -mlittle-endian -mabi=lp64 -g -g -g -O2 -O2 -O2 -fbuilding-libgcc -fno-stack-protector -fPIC |
| Number of processes observed | 1 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Number of threads observed | 64 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Frequency Driver | NA | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Frequency Governor | NA | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Huge Pages | madvise | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Hyperthreading | off | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Number of sockets | 1 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Number of cores per socket | 64 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| MAQAO version | 2025.1.2 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| MAQAO build | 3c12046452d68b38e394be5cd9e057265a89bbcf::20250812-175904 | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |
| Comments | Molecular Dynamics AWS Graviton 3 (Neoverse V1 CPU), 2-64 threads runs | same as r0 | same as r0 | same as r0 | same as r0 | same as r0 |