Translations:AMBER/30/en
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Amber 20[edit]
There are two versions of amber/20 modules: 20.9-20.15 and 20.12-20.15. The first one uses MKL and cuda/11.0, while the second uses FlexiBLAS and cuda/11.4. MKL libraries do not perform well on AMD CPU, and FlexiBLAS solves this problem. It detects CPU type and uses libraries optimized for the hardware. cuda/11.4 is required for running simulations on A100 GPUs installed on Narval.