Re: [AMBER] CUDA compilation after PLUMED patching

From: David A Case via AMBER <amber.ambermd.org>
Date: Thu, 27 Feb 2025 11:48:41 -0700

On Wed, Feb 26, 2025, Kriti Shukla via AMBER wrote:
> -DPLUMED_LIBRARY=/home/23cy91f06/plumed-2.9.3/lib/libplumed.so \
>
>-DPLUMED_KERNEL_LIBRARY=/home/23cy91f06/plumed-2.9.3/lib/libplumedKernel.so
>\
> -DPLUMED_INCLUDES=/home/23cy91f06/plumed-2.9.3/include \
> -DPLUMED_WORKS=/home/23cy91f06/plumed-2.9.3 \

>[ 96%] Linking Fortran executable pmemd.cuda_SPFP
>/usr/bin/ld: cannot find -lplumed
>collect2: error: ld returned 1 exit status

Just a guess: try adding /home/23cy91f06/plumed-2.9.3/lib to your
LD_LIBRARY_PATH environment variable. It may be that the cuda build path is
not correctly using PLUMED_LIBRARY.

Caveat: I'm not a plumed person; just look at your error message.

What also may help: run "VERBOSE=1 make install" instead of "make install".
That will give more details of exactly what is happening.

...good luck...dac


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Received on Thu Feb 27 2025 - 11:00:02 PST
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