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Commit be831bb2 authored by Gareth Tribello's avatar Gareth Tribello
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Replaced --stride with --trajectory-stride in driver

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regtest/rt0/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt1/config
+ 1
− 1
View file @ be831bb2
......@@ -3,4 +3,4 @@
# to avoid problems with the numerical derivatives (it is exactly at the border between
# two images)
type=driver
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
regtest/rt10-restart/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f
--box 5.0388,5.0388,5.0388"
extra_files="../trajectories/trajectory.xyz"
regtest/rt10/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f
--box 5.0388,5.0388,5.0388"
extra_files="../trajectories/trajectory.xyz"
regtest/rt11/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt12/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt14/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt15/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt16/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f --pdb test.pdb"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f --pdb test.pdb"
extra_files="../trajectories/trajectory.xyz"
regtest/rt17/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt18/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt19-mpi/config
+ 1
− 1
View file @ be831bb2
mpiprocs=4
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt19/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt2/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt20-mpi/config
+ 1
− 1
View file @ be831bb2
mpiprocs=4
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt20/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt21/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt22/config
+ 1
− 1
View file @ be831bb2
type=driver
# this is to test a different name
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%8.4f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt26/config
+ 1
− 1
View file @ be831bb2
type=driver
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f"
extra_files="../trajectories/trajectory.xyz"
regtest/rt27/config
+ 1
− 1
View file @ be831bb2
type=driver
arg="--plumed plumed.dat --stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f"
arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --ixyz trajectory.xyz --dump-forces forces --dump-forces-fmt=%10.6f"
extra_files="../trajectories/trajectory.xyz"
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