From: Ropon-Palacios G. (biodano.geo_at_gmail.com)
Date: Wed Apr 14 2021 - 13:22:03 CDT
Dear user,
I’m try run NAMD on 4 node each with 2 GPU Tesla K80
My PBS file
#PBS -N test_nand_GPU
#PBS -l nodes=n004+n005+n006:ppn=28:gpus=2
cd $PBS_O_WORKDIR
/opt/shared/NAMD_2.13-multinode-gpu/charmrun /opt/shared/NAMD_2.13-multinode-gpu/namd2 +idlepoll +p 12 +devices 0 ++ppn 4 run_fixed/md_run.namd | tee md2.log
When set “+devices 0,1” not run, only run when set to 0 .
How can correct it?
Help me.
Geo.
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