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AMBER Archive (2009)Subject: [AMBER] Unit 5 Error on OPEN:mdin on clustuer with mpirun
From: drugdesign (drugdesign_at_yandex.ru)
Dear Amber users,
mpirun -np 256 -maxtime 1500 $AMBERHOME/exe/sander.MPI -O -i
or
mpirun -np 256 -maxtime 1500 sander.MPI -O -i gb_md1_nocut.in -o fzd9_gb_md1_nocut.out -c fzd9_gb_init_min.rst -p fzd9.prmtop -r fzd9_md1_nocut.rst -x fzd9_gb_md1_nocut.mdcrd
Input files are in my home folder.
Unit 5 Error on OPEN:mdin
Best regards,
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