Translations:GROMACS/104/fr

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GROMACS modules pour utiliser les CPU modules pour utiliser les GPU (CUDA) Notes
gromacs/2024.1 StdEnv/2023 gcc/12.3 openmpi/4.1.5 gromacs/2024.1 StdEnv/2023 gcc/12.3 openmpi/4.1.5 cuda/12.2 gromacs/2024.1 GCC, FlexiBLAS & FFTW
gromacs/2023.3 StdEnv/2023 gcc/12.3 openmpi/4.1.5 gromacs/2023.3 StdEnv/2023 gcc/12.3 openmpi/4.1.5 cuda/12.2 gromacs/2023.3 GCC, FlexiBLAS & FFTW
GROMACS modules pour utiliser les CPU modules pour utiliser les GPU (CUDA) Notes
gromacs/2023.2 StdEnv/2020 gcc/9.3.0 openmpi/4.0.3 gromacs/2023.2 StdEnv/2020 gcc/9.3.0 cuda/11.4 openmpi/4.0.3 gromacs/2023.2 GCC, FlexiBLAS & FFTW
gromacs/2023 StdEnv/2020 gcc/9.3.0 openmpi/4.0.3 gromacs/2023 StdEnv/2020 gcc/9.3.0 cuda/11.4 openmpi/4.0.3 gromacs/2023 GCC, FlexiBLAS & FFTW
gromacs/2022.3 StdEnv/2020 gcc/9.3.0 openmpi/4.0.3 gromacs/2022.3 StdEnv/2020 gcc/9.3.0 cuda/11.4 openmpi/4.0.3 gromacs/2022.3 GCC, FlexiBLAS & FFTW
gromacs/2022.2 StdEnv/2020 gcc/9.3.0 openmpi/4.0.3 gromacs/2022.2 GCC, FlexiBLAS & FFTW
gromacs/2021.6 StdEnv/2020 gcc/9.3.0 openmpi/4.0.3 gromacs/2021.6 StdEnv/2020 gcc/9.3.0 cuda/11.4 openmpi/4.0.3 gromacs/2021.6 GCC, FlexiBLAS & FFTW
gromacs/2021.4 StdEnv/2020 gcc/9.3.0 openmpi/4.0.3 gromacs/2021.4 StdEnv/2020 gcc/9.3.0 cuda/11.4 openmpi/4.0.3 gromacs/2021.4 warning GCC, FlexiBLAS & FFTW
gromacs/2021.2 StdEnv/2020 gcc/9.3.0 cuda/11.4 openmpi/4.0.3 gromacs/2021.2 warning GCC, FlexiBLAS & FFTW
gromacs/2021.2 StdEnv/2020 gcc/9.3.0 openmpi/4.0.3 gromacs/2021.2 StdEnv/2020 gcc/9.3.0 cuda/11.0 openmpi/4.0.3 gromacs/2021.2 warning GCC & MKL
gromacs/2020.6 StdEnv/2020 gcc/9.3.0 openmpi/4.0.3 gromacs/2020.6 StdEnv/2020 gcc/9.3.0 cuda/11.4 openmpi/4.0.3 gromacs/2020.6 warning GCC, FlexiBLAS & FFTW
gromacs/2020.4 StdEnv/2020 gcc/9.3.0 cuda/11.4 openmpi/4.0.3 gromacs/2020.4 warning GCC, FlexiBLAS & FFTW
gromacs/2020.4 StdEnv/2020 gcc/9.3.0 openmpi/4.0.3 gromacs/2020.4 StdEnv/2020 gcc/9.3.0 cuda/11.0 openmpi/4.0.3 gromacs/2020.4 warning GCC & MKL
GROMACS version modules for running on CPUs modules for running on GPUs (CUDA) Notes
gromacs/2020.2 StdEnv/2018.3 gcc/7.3.0 openmpi/3.1.2 gromacs/2020.2 StdEnv/2018.3 gcc/7.3.0 cuda/10.0.130 openmpi/3.1.2 gromacs/2020.2 warning GCC & MKL
gromacs/2019.6 StdEnv/2018.3 gcc/7.3.0 openmpi/3.1.2 gromacs/2019.6 StdEnv/2018.3 gcc/7.3.0 cuda/10.0.130 openmpi/3.1.2 gromacs/2019.6 GCC & MKL
gromacs/2019.3 StdEnv/2018.3 gcc/7.3.0 openmpi/3.1.2 gromacs/2019.3 StdEnv/2018.3 gcc/7.3.0 cuda/10.0.130 openmpi/3.1.2 gromacs/2019.3 GCC & MKL  ‡
gromacs/2018.7 StdEnv/2018.3 gcc/7.3.0 openmpi/3.1.2 gromacs/2018.7 StdEnv/2018.3 gcc/7.3.0 cuda/10.0.130 openmpi/3.1.2 gromacs/2018.7 GCC & MKL
GROMACS version modules for running on CPUs modules for running on GPUs (CUDA) Notes
gromacs/2018.3 StdEnv/2016.4 gcc/6.4.0 openmpi/2.1.1 gromacs/2018.3 StdEnv/2016.4 gcc/6.4.0 cuda/9.0.176 openmpi/2.1.1 gromacs/2018.3 GCC & FFTW
gromacs/2018.2 StdEnv/2016.4 gcc/6.4.0 openmpi/2.1.1 gromacs/2018.2 StdEnv/2016.4 gcc/6.4.0 cuda/9.0.176 openmpi/2.1.1 gromacs/2018.2 GCC & FFTW
gromacs/2018.1 StdEnv/2016.4 gcc/6.4.0 openmpi/2.1.1 gromacs/2018.1 StdEnv/2016.4 gcc/6.4.0 cuda/9.0.176 openmpi/2.1.1 gromacs/2018.1 GCC & FFTW
gromacs/2018 StdEnv/2016.4 gromacs/2018 StdEnv/2016.4 cuda/9.0.176 gromacs/2018 Intel & MKL
gromacs/2016.5 StdEnv/2016.4 gcc/6.4.0 openmpi/2.1.1 gromacs/2016.5 StdEnv/2016.4 gcc/6.4.0 cuda/9.0.176 openmpi/2.1.1 gromacs/2016.5 GCC & FFTW
gromacs/2016.3 StdEnv/2016.4 gromacs/2016.3 StdEnv/2016.4 cuda/8.0.44 gromacs/2016.3 Intel & MKL
gromacs/5.1.5 StdEnv/2016.4 gromacs/5.1.5 StdEnv/2016.4 cuda/8.0.44 gromacs/5.1.5 Intel & MKL
gromacs/5.1.4 StdEnv/2016.4 gromacs/5.1.4 StdEnv/2016.4 cuda/8.0.44 gromacs/5.1.4 Intel & MKL
gromacs/5.0.7 StdEnv/2016.4 gromacs/5.0.7 StdEnv/2016.4 cuda/8.0.44 gromacs/5.0.7 Intel & MKL
gromacs/4.6.7 StdEnv/2016.4 gromacs/4.6.7 StdEnv/2016.4 cuda/8.0.44 gromacs/4.6.7 Intel & MKL
gromacs/4.6.7 StdEnv/2016.4 gcc/5.4.0 openmpi/2.1.1 gromacs/4.6.7 StdEnv/2016.4 gcc/5.4.0 cuda/8.0 openmpi/2.1.1 gromacs/4.6.7 GCC & MKL & ThreadMPI