Re: [AMBER] Random segfaults (invalid memory reference) in sander

From: Daniel Roe <>
Date: Wed, 15 May 2019 11:52:10 -0400

On Mon, May 6, 2019 at 10:52 AM David A Case <> wrote:
> No, I don't think so. You could hand-edit your config.h file, remove
> references to libmpi_cxx and try to just re-compile sander. But I'm
> thinking that only cpptraj.MPI needs this library.

Just for posterity, under the hood cpptraj.MPI only uses the C API for
MPI, so no dependency on libmpi_cxx.


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Received on Wed May 15 2019 - 09:00:03 PDT
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