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Commit 50bf5314 authored by Giovanni Bussi's avatar Giovanni Bussi
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Test READ EVERY with atoms

See #619
parent 9b89f9fe
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#! FIELDS time r2
0.000000 1.4960
0.050000 1.5030
0.100000 1.4960
0.150000 1.5020
0.200000 1.5020
#! FIELDS time rmsd0 rmsds0 rmsd1 rmsds1 rmsd2 rmsds2 rmsd3 rmsds3 rmsd4 rmsds4 sum @11.bias @11.force2
0.000000 1.496 1.643 1.496 1.643 1.337 1.486 1.336 1.486 2.329 2.130 16.381 6.550 13.100
0.050000 1.502 1.650 1.503 1.650 1.347 1.497 1.347 1.496 2.332 2.128 16.452 6.294 12.589
0.100000 1.503 1.653 1.504 1.653 1.351 1.502 1.350 1.501 2.324 2.120 16.461 6.262 12.525
0.150000 1.502 1.653 1.502 1.654 1.350 1.503 1.350 1.503 2.308 2.108 16.433 6.361 12.721
0.200000 1.496 1.649 1.496 1.649 1.347 1.500 1.346 1.499 2.278 2.080 16.340 6.696 13.392
0.000000 1.496 1.643 1.496 1.643 1.337 1.486 1.336 1.486 2.329 2.130 16.381 6.550 13.100
0.050000 1.502 1.650 1.503 1.650 1.347 1.497 1.347 1.496 2.332 2.128 16.452 6.294 12.589
0.100000 1.503 1.653 1.504 1.653 1.351 1.502 1.350 1.501 2.324 2.120 16.461 6.262 12.525
0.150000 1.502 1.653 1.502 1.654 1.350 1.503 1.350 1.503 2.308 2.108 16.433 6.361 12.721
0.200000 1.496 1.649 1.496 1.649 1.347 1.500 1.346 1.499 2.278 2.080 16.340 6.696 13.392
......@@ -22,6 +22,9 @@ PRINT ARG=* FILE=COLVAR.nores.gz FMT=%6.3f RESTART=NO
r1: READ VALUES=rmsd0 FILE=input_colvar.gz
PRINT ARG=r1 STRIDE=10 FILE=CC.gz FMT=%8.4f
r2: READ VALUES=rmsd0 FILE=input_colvar2 EVERY=2 IGNORE_TIME
PRINT ARG=r2 FILE=CC2 FMT=%8.4f
METAD FILE=HH.gz ARG=rmsd0 SIGMA=1 HEIGHT=0.1 PACE=10 FMT=%10.6f
ENDPLUMED
......
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