diff --git a/regtest/basic/rt-ghost-1/config b/regtest/basic/rt-ghost-1/config index 7b2cb650eca9bfb72f527abb05ddd223845c270d..83a65f73deebe98818dbfac0e5425d34d2ae4ece 100644 --- a/regtest/basic/rt-ghost-1/config +++ b/regtest/basic/rt-ghost-1/config @@ -1,3 +1,3 @@ type=driver +plumed_needs="matheval" arg="--plumed plumed.dat --ixyz trajectory.xyz --dump-forces ff --dump-forces-fmt=%10.6f --dump-full-virial" -export PLUMED_USE_LEPTON=yes diff --git a/regtest/basic/rt-maxent-1/config b/regtest/basic/rt-maxent-1/config index abf1fa487167a6bdeba340ddc13b6cf79a0e2cf2..513d265c869bb65e1bd07da88e3ab255321a7323 100644 --- a/regtest/basic/rt-maxent-1/config +++ b/regtest/basic/rt-maxent-1/config @@ -1,3 +1,3 @@ type=driver +plumed_needs="matheval" arg="--plumed plumed.dat --mf_xtc traj.xtc --dump-forces forces --dump-forces-fmt=%8.4f" -export PLUMED_USE_LEPTON=yes diff --git a/regtest/basic/rt-maxent-2/config b/regtest/basic/rt-maxent-2/config index 8d96fd6b8431a783fa3daea5750f3a6ceeacb8a7..513d265c869bb65e1bd07da88e3ab255321a7323 100644 --- a/regtest/basic/rt-maxent-2/config +++ b/regtest/basic/rt-maxent-2/config @@ -1,4 +1,3 @@ type=driver +plumed_needs="matheval" arg="--plumed plumed.dat --mf_xtc traj.xtc --dump-forces forces --dump-forces-fmt=%8.4f" -export PLUMED_USE_LEPTON=yes - diff --git a/regtest/basic/rt-maxent-3/config b/regtest/basic/rt-maxent-3/config index cf1eacb4d9aa90082258c6789bca47bb32ea75ea..c19de798f61b0fddd8483b71f4a109280861b366 100644 --- a/regtest/basic/rt-maxent-3/config +++ b/regtest/basic/rt-maxent-3/config @@ -1,6 +1,5 @@ mpiprocs=6 type=driver +plumed_needs="matheval" # this is to test a different name arg="--plumed plumed.dat --mf_xtc traj.xtc --dump-forces forces --multi 6 --dump-forces-fmt=%8.4f" -export PLUMED_USE_LEPTON=yes - diff --git a/regtest/basic/rt-maxent-4/config b/regtest/basic/rt-maxent-4/config index 2cd7d1f8cca7e0781d485f9a5f8b946052234ee6..2dacd25cd89921389b17a1a6019890a5751e11b0 100644 --- a/regtest/basic/rt-maxent-4/config +++ b/regtest/basic/rt-maxent-4/config @@ -1,4 +1,4 @@ mpiprocs=6 type=driver +plumed_needs="matheval" arg="--plumed plumed.dat --mf_xtc traj.xtc --dump-forces forces --dump-forces-fmt=%8.4f --debug-dd" -export PLUMED_USE_LEPTON=yes diff --git a/regtest/basic/rt-maxent-5/config b/regtest/basic/rt-maxent-5/config index 16036960e46df27dd70d14d0dfbbfe62535dc50a..3d1aed0c16555f2509e379339e224f2b928d378a 100644 --- a/regtest/basic/rt-maxent-5/config +++ b/regtest/basic/rt-maxent-5/config @@ -1,4 +1,4 @@ mpiprocs=6 type=driver +plumed_needs="matheval" arg="--plumed plumed.dat --mf_xtc traj.xtc --dump-forces forces --multi 3 --dump-forces-fmt=%8.4f --debug-dd" -export PLUMED_USE_LEPTON=yes diff --git a/regtest/basic/rt23/config b/regtest/basic/rt23/config index 4fae92952b661a103d125802ec6c1a6d036a34cc..36ac598179e9e45f286fbfc5db818537a5b30621 100644 --- a/regtest/basic/rt23/config +++ b/regtest/basic/rt23/config @@ -1,5 +1,4 @@ type=driver # this is to test a different name arg="--plumed plumed.dat --ixyz trajectory.xyz --dump-forces forces.xyz --dump-forces-fmt=%10.6f" -export PLUMED_USE_LEPTON=yes - +plumed_needs="matheval" diff --git a/regtest/basic/rt63c-mpi/config b/regtest/basic/rt63c-mpi/config index fbe364f0b0b10654c99085eb2dd1a27b57131923..9e7954b34313fa58bce88d8294912400f67f0ffa 100644 --- a/regtest/basic/rt63c-mpi/config +++ b/regtest/basic/rt63c-mpi/config @@ -1,4 +1,4 @@ type=driver mpiprocs=2 +plumed_needs="matheval" arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --igro helix.input.gro --dump-forces ff --dump-full-virial --dump-forces-fmt=%7.4f --debug-dd" -export PLUMED_USE_LEPTON=yes diff --git a/regtest/basic/rt63c/config b/regtest/basic/rt63c/config index fc77b1e66d84156546fbe0abc8d573cbcf686bfb..20ada5f7126539dc5784ccabdb4da927c9b423ff 100644 --- a/regtest/basic/rt63c/config +++ b/regtest/basic/rt63c/config @@ -1,3 +1,3 @@ type=driver +plumed_needs="matheval" arg="--plumed plumed.dat --trajectory-stride 10 --timestep 0.005 --igro helix.input.gro --dump-forces ff --dump-full-virial --dump-forces-fmt=%7.4f" -export PLUMED_USE_LEPTON=yes