diff --git a/src/colvar/Puckering.cpp b/src/colvar/Puckering.cpp index 52cedb4c6a12c665a49dcbcf32f929cbfaf7b0e2..89f2a40187689771fae35dda85fa9b6a6a920d68 100644 --- a/src/colvar/Puckering.cpp +++ b/src/colvar/Puckering.cpp @@ -67,7 +67,7 @@ namespace colvar { \plumedfile #SETTINGS MOLFILE=regtest/basic/rt65/AA.pdb MOLINFO STRUCTURE=rna.pdb MOLTYPE=rna - PUCKERING ATOMS=@sugar-3 LABEL=puck + PUCKERING ATOMS=@sugar-2 LABEL=puck PRINT ARG=puck.phs FILE=COLVAR \endplumedfile diff --git a/src/function/Piecewise.cpp b/src/function/Piecewise.cpp index 334a29d9bd849f97213b02145ab4c05a6b8cccb0..751814eb57d1ec4e64c6dc63bec5c33c8fb5f7f0 100644 --- a/src/function/Piecewise.cpp +++ b/src/function/Piecewise.cpp @@ -59,8 +59,8 @@ argument with suffix _pfunc. dist1: DISTANCE ATOMS=1,10 dist2: DISTANCE ATOMS=2,11 -pw: PIECEWISE POINT0=1,10 POINT1=1,PI POINT2=3,10 ARG=dist1 -ppww: PIECEWISE POINT0=1,10 POINT1=1,PI POINT2=3,10 ARG=dist1,dist2 +pw: PIECEWISE POINT0=1,10 POINT1=2,PI POINT2=3,10 ARG=dist1 +ppww: PIECEWISE POINT0=1,10 POINT1=2,PI POINT2=3,10 ARG=dist1,dist2 PRINT ARG=pw,ppww.dist1_pfunc,ppww.dist2_pfunc \endplumedfile