Re: [AMBER] Parallel test stuck at Run.dhfr.noboxinfo

From: David A Case <>
Date: Wed, 15 Dec 2021 08:45:03 -0500

On Tue, Dec 14, 2021, Yu Chen wrote:
>I tried to install Amber 20 with AmberTools 21 on Ubuntu 20.04, using
>gcc/8.4.0 and openmpi-1.10.7.

You should upgrade openmpi. Version 1.10 is listed as "ancient"
at, and the current supported
version is version 4.0.7. Back in 2017, it was reported that openmpi 1.10
fails in exactly the way you see:

Upgrading openmpi solved the problem back in 2017, so I hope the upgrade fix
will still work for you.


p.s. I found the message above by doing a Google search on "amber
Run.dhfr.noboxinfo". It's surprising how often doing a search on a Amber
error message will lead to useful information.

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Received on Wed Dec 15 2021 - 06:00:02 PST
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