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AMBER: Difference between revisions
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Non-GPU versions | '''Non-GPU versions''' | ||
module load gcc/5.4.0 openmpi/2.1.1 amber/18 scipy-stack/2019a | module load gcc/5.4.0 openmpi/2.1.1 amber/18 scipy-stack/2019a | ||
or | or | ||
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GPU versions | '''GPU versions''' | ||
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In examples below, change the module load command to one above if you wish to use the newer version. | In examples below, change the <tt>module load</tt> command to the one shown above if you wish to use the newer version. | ||
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