AMBER: Difference between revisions

AMBER (view source)

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 ! AMBER version !! modules for running on CPUs !! modules for running on GPUs (CUDA) !! Notes
 |-
-| amber/22.5-23.5 || <code> StdEnv/2023 gcc/12.3 openmpi/4.1.5 cuda/12.2 amber/22.5-23.5</code> || <code>StdEnv/2023 gcc/12.3 openmpi/4.1.5 amber/22.5-23.5</code> || GCC, FlexiBLAS & FFTW
+| amber/22.5-23.5 || <code> StdEnv/2023 gcc/12.3 openmpi/4.1.5  amber/22.5-23.5</code> || <code>StdEnv/2023 gcc/12.3 openmpi/4.1.5 cuda/12.2 amber/22.5-23.5</code> || GCC, FlexiBLAS & FFTW
 |-
-| ambertools/23.5 || <code> StdEnv/2023 gcc/12.3 openmpi/4.1.5 cuda/12.2 ambertools/23.5</code> || <code>StdEnv/2023 gcc/12.3 openmpi/4.1.5 ambertools/23.5</code> || GCC, FlexiBLAS & FFTW
+| ambertools/23.5 || <code> StdEnv/2023 gcc/12.3 openmpi/4.1.5 ambertools/23.5</code> || <code>StdEnv/2023 gcc/12.3 openmpi/4.1.5 cuda/12.2 ambertools/23.5</code> || GCC, FlexiBLAS & FFTW
 |-
 |}</tab>