Re: [AMBER] Testing pmemd.cuda.MPI - how many failed file comparisons are innocuous?

From: David A Case <>
Date: Fri, 12 Feb 2021 07:07:53 -0500

On Fri, Feb 12, 2021, Nikolay N. Kuzmich wrote:
>I have installed the GPU version of pmemd (Amber 20) in parallel and ran
>the tests for both 2 and 4 GPUs. The numbers of failed file comparisons
>were 13 out of 135 and 33 out of 189 for 2 and 4 GPUs, respectively. These
>results worry me a bit...

Can you say exactly what test you ran, i.e. what command did you type to run
the tests?


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Received on Fri Feb 12 2021 - 04:30:03 PST
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