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Commit 72d14db4 authored by Massimiliano Bonomi's avatar Massimiliano Bonomi
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selector/select regtest

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#! FIELDS time r1.bias r2.bias sr1 sr2
0.000000 12.500000 25.000000 12.500000 25.000000
1.000000 12.500000 25.000000 12.500000 25.000000
2.000000 12.500000 25.000000 12.500000 25.000000
3.000000 12.500000 25.000000 12.500000 25.000000
include ../../scripts/test.make
mpiprocs=1
type=driver
arg="--plumed plumed.dat --ixyz traj.xyz"
d1: DISTANCE ATOMS=1,2
d2: DISTANCE ATOMS=2,4
r1: RESTRAINT ARG=d1 AT=0.0 KAPPA=1.0
r2: RESTRAINT ARG=d2 AT=0.0 KAPPA=1.0
SELECTOR NAME=s1 VALUE=0
SELECTOR NAME=s2 VALUE=1
sr1: SELECT ARG=r1.bias,r2.bias SELECTOR=s1
sr2: SELECT ARG=r1.bias,r2.bias SELECTOR=s2
PRINT ARG=r1.bias,r2.bias,sr1,sr2 FILE=COLVAR STRIDE=1
4
100 100 100
X 5 0 0
X 0 0 0
X 0 5 0
X 5 5 0
4
100 100 100
X 5 0 0
X 0 0 0
X 0 5 0
X 0 5 5
4
100 100 100
X 5 0 0
X 0 0 0
X 0 5 0
X -5 5 0
4
100 100 100
X 5 0 0
X 0 0 0
X 0 5 0
X 0 5 -5
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