diff --git a/src/colvar/Puckering.cpp b/src/colvar/Puckering.cpp index 762b87df73..49a4203642 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 b45399581d..d53a5dd50f 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