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AMBER: Difference between revisions
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source $EBROOTAMBERTOOLS/amber.sh | source $EBROOTAMBERTOOLS/amber.sh | ||
Provides the following MD engines: sander, sander.LES, sander.LES.MPI, sander.MPI, sander.OMP | Provides the following MD engines: sander, sander.LES, sander.LES.MPI, sander.MPI, and sander.OMP | ||
=== GPU version === <!--T:17--> | === GPU version === <!--T:17--> | ||
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source $EBROOTAMBERTOOLS/amber.sh | source $EBROOTAMBERTOOLS/amber.sh | ||
Provides the following MD engines: sander, sander.LES, sander.LES.MPI, sander.MPI, sander.OMP, sander.quick.cuda, sander.quick.cuda.MPI | Provides the following MD engines: sander, sander.LES, sander.LES.MPI, sander.MPI, sander.OMP, sander.quick.cuda, and sander.quick.cuda.MPI | ||
==Loading Amber 20== <!--T:8--> | ==Loading Amber 20== <!--T:8--> | ||