Regtest updated.

0db0e618 · Marco · 3f9e1a9c · 0db0e618
Commit 0db0e618 authored 7 years ago by Marco
--- a/regtest/basic/rt-dimer-1/plumed.dat
+++ b/regtest/basic/rt-dimer-1/plumed.dat
-dim: DIMER NATOMS=22 ATOMS=1,3,14,17 Q=0.5 TEMP=300 DSIGMA=0.002
+GROUP ATOMS=1,3,14,17 LABEL=d1g1
+GROUP ATOMS=23,25,36,39 LABEL=d1g2
+
+dim: DIMER ATOMS1=d1g1 ATOMS2=d1g2 Q=0.5 TEMP=300 DSIGMA=0.002

 DUMPDERIVATIVES ARG=dim STRIDE=1 FILE=deriv FMT=%8.4f
 PRINT ARG=dim FILE=colvar FMT=%8.4f