Thanks! will do.
And I did do a google search on this, but didn't get that result ... (I
always wonder why people don't do a google search before they ask ..., I
guess sometimes it just happens, will search harder next time. )
y.c.
On Wed, Dec 15, 2021 at 8:45 AM David A Case <david.case.rutgers.edu> wrote:
> 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 https://www.open-mpi.org/software/ompi/v4.1/, 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:
>
> http://archive.ambermd.org/201701/0578.html
>
> Upgrading openmpi solved the problem back in 2017, so I hope the upgrade
> fix
> will still work for you.
>
> ....dac
>
> 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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>
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Received on Wed Dec 15 2021 - 07:00:02 PST
