PLUMED-NEST

Project ID: plumID:19.081
Source: Na/03_MultithermalMultibaric/Reweight/plumed.dat
Originally used with PLUMED version: 2.6-dev
Stable: zipped raw stdout - zipped raw stderr - stderr
Master: zipped raw stdout - zipped raw stderr - stderr

Click on the labels of the actions for more information on what each action computes

# vim:ft=plumedEnables syntax highlighting for PLUMED files in vim. See here for more details. 

energy: READRead quantities from a colvar file. More details FILEthe name of the file from which to read these quantities=COLVARtrim VALUESthe values to read from the file=energy  IGNORE_TIME ignore the time in the colvar file
The READ action with label energy calculates the following quantities:
 Quantity   
 Description  
energy..#!custom
the names of the output components for this action depend on the actions input file see the example inputs below for detailsb1: READRead quantities from a colvar file. More details FILEthe name of the file from which to read these quantities=COLVARtrim VALUESthe values to read from the file=b1.bias  IGNORE_TIME ignore the time in the colvar file
The READ action with label b1 calculates the following quantities:
 Quantity   
 Description  
b1..#!custom
the names of the output components for this action depend on the actions input file see the example inputs below for detailsuwall: READRead quantities from a colvar file. More details FILEthe name of the file from which to read these quantities=COLVARtrim VALUESthe values to read from the file=uwall.bias IGNORE_TIME ignore the time in the colvar file
The READ action with label uwall calculates the following quantities:
 Quantity   
 Description  
uwall..#!custom
the names of the output components for this action depend on the actions input file see the example inputs below for detailsrefcv: READRead quantities from a colvar file. More details FILEthe name of the file from which to read these quantities=COLVARtrim VALUESthe values to read from the file=refcv.morethan  IGNORE_TIME ignore the time in the colvar file
The READ action with label refcv calculates the following quantities:
 Quantity   
 Description  
refcv..#!custom
the names of the output components for this action depend on the actions input file see the example inputs below for detailsvoltmp: READRead quantities from a colvar file. More details FILEthe name of the file from which to read these quantities=COLVARtrim VALUESthe values to read from the file=vol  IGNORE_TIME ignore the time in the colvar file

The READ action with label voltmp calculates the following quantities:
 Quantity   
 Description  
voltmp..#!custom
the names of the output components for this action depend on the actions input file see the example inputs below for detailsvol: COMBINECalculate a polynomial combination of a set of other variables. More details ARGthe values input to this function=voltmp PARAMETERS the parameters of the arguments in your function=10.0 PERIODICif the output of your function is periodic then you should specify the periodicity of the function=NO
The COMBINE action with label vol calculates the following quantities:
 Quantity   
 Description  
vol.value
a linear compbinationrenergy: COMBINECalculate a polynomial combination of a set of other variables. More details ARGthe values input to this function=energy PARAMETERS the parameters of the arguments in your function=-25000 PERIODICif the output of your function is periodic then you should specify the periodicity of the function=NO
The COMBINE action with label renergy calculates the following quantities:
 Quantity   
 Description  
renergy.value
a linear compbinationweights: REWEIGHT_BIASCalculate weights for ensemble averages that negate the effect the bias has on the region of phase space explored More details TEMPthe system temperature=400. ARG the biases that must be taken into account when reweighting=b1.bias,uwall.bias

The REWEIGHT_BIAS action with label weights calculates the following quantities:
 Quantity   
 Description  
weights.value
the weight to use for this frame to negate the effect the biasweights350-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-0 calculates the following quantities:
 Quantity   
 Description  
weights350-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-0 calculates the following quantities:
 Quantity   
 Description  
hh350-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-0 FILE the file on which to write the grid=histo350-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
The DUMPGRID action with label  calculates somethingff350-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-0 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-0 calculates the following quantities:
 Quantity   
 Description  
ff350-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-0 FILE the file on which to write the grid=fes350-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights350-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-1000 calculates the following quantities:
 Quantity   
 Description  
weights350-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-1000 calculates the following quantities:
 Quantity   
 Description  
hh350-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-1000 FILE the file on which to write the grid=histo350-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff350-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-1000 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-1000 calculates the following quantities:
 Quantity   
 Description  
ff350-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-1000 FILE the file on which to write the grid=fes350-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights350-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-2000 calculates the following quantities:
 Quantity   
 Description  
weights350-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-2000 calculates the following quantities:
 Quantity   
 Description  
hh350-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-2000 FILE the file on which to write the grid=histo350-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff350-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-2000 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-2000 calculates the following quantities:
 Quantity   
 Description  
ff350-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-2000 FILE the file on which to write the grid=fes350-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights350-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-3000 calculates the following quantities:
 Quantity   
 Description  
weights350-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-3000 calculates the following quantities:
 Quantity   
 Description  
hh350-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-3000 FILE the file on which to write the grid=histo350-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff350-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-3000 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-3000 calculates the following quantities:
 Quantity   
 Description  
ff350-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-3000 FILE the file on which to write the grid=fes350-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights350-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-4000 calculates the following quantities:
 Quantity   
 Description  
weights350-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-4000 calculates the following quantities:
 Quantity   
 Description  
hh350-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-4000 FILE the file on which to write the grid=histo350-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff350-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-4000 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-4000 calculates the following quantities:
 Quantity   
 Description  
ff350-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-4000 FILE the file on which to write the grid=fes350-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights350-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-5000 calculates the following quantities:
 Quantity   
 Description  
weights350-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-5000 calculates the following quantities:
 Quantity   
 Description  
hh350-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-5000 FILE the file on which to write the grid=histo350-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff350-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-5000 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-5000 calculates the following quantities:
 Quantity   
 Description  
ff350-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-5000 FILE the file on which to write the grid=fes350-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights350-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-6000 calculates the following quantities:
 Quantity   
 Description  
weights350-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-6000 calculates the following quantities:
 Quantity   
 Description  
hh350-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-6000 FILE the file on which to write the grid=histo350-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff350-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-6000 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-6000 calculates the following quantities:
 Quantity   
 Description  
ff350-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-6000 FILE the file on which to write the grid=fes350-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights350-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-7000 calculates the following quantities:
 Quantity   
 Description  
weights350-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-7000 calculates the following quantities:
 Quantity   
 Description  
hh350-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-7000 FILE the file on which to write the grid=histo350-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff350-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-7000 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-7000 calculates the following quantities:
 Quantity   
 Description  
ff350-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-7000 FILE the file on which to write the grid=fes350-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights350-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-8000 calculates the following quantities:
 Quantity   
 Description  
weights350-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-8000 calculates the following quantities:
 Quantity   
 Description  
hh350-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-8000 FILE the file on which to write the grid=histo350-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff350-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-8000 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-8000 calculates the following quantities:
 Quantity   
 Description  
ff350-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-8000 FILE the file on which to write the grid=fes350-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights350-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-9000 calculates the following quantities:
 Quantity   
 Description  
weights350-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-9000 calculates the following quantities:
 Quantity   
 Description  
hh350-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-9000 FILE the file on which to write the grid=histo350-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff350-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-9000 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-9000 calculates the following quantities:
 Quantity   
 Description  
ff350-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-9000 FILE the file on which to write the grid=fes350-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights350-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=350.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights350-10000 calculates the following quantities:
 Quantity   
 Description  
weights350-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights350-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh350-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh350-10000 calculates the following quantities:
 Quantity   
 Description  
hh350-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh350-10000 FILE the file on which to write the grid=histo350-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff350-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh350-10000 TEMPthe temperature at which you are operating=350.0
The CONVERT_TO_FES action with label ff350-10000 calculates the following quantities:
 Quantity   
 Description  
ff350-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff350-10000 FILE the file on which to write the grid=fes350-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-0 calculates the following quantities:
 Quantity   
 Description  
weights360-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-0 calculates the following quantities:
 Quantity   
 Description  
hh360-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-0 FILE the file on which to write the grid=histo360-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-0 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-0 calculates the following quantities:
 Quantity   
 Description  
ff360-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-0 FILE the file on which to write the grid=fes360-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-1000 calculates the following quantities:
 Quantity   
 Description  
weights360-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-1000 calculates the following quantities:
 Quantity   
 Description  
hh360-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-1000 FILE the file on which to write the grid=histo360-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-1000 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-1000 calculates the following quantities:
 Quantity   
 Description  
ff360-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-1000 FILE the file on which to write the grid=fes360-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-2000 calculates the following quantities:
 Quantity   
 Description  
weights360-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-2000 calculates the following quantities:
 Quantity   
 Description  
hh360-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-2000 FILE the file on which to write the grid=histo360-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-2000 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-2000 calculates the following quantities:
 Quantity   
 Description  
ff360-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-2000 FILE the file on which to write the grid=fes360-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-3000 calculates the following quantities:
 Quantity   
 Description  
weights360-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-3000 calculates the following quantities:
 Quantity   
 Description  
hh360-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-3000 FILE the file on which to write the grid=histo360-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-3000 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-3000 calculates the following quantities:
 Quantity   
 Description  
ff360-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-3000 FILE the file on which to write the grid=fes360-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-4000 calculates the following quantities:
 Quantity   
 Description  
weights360-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-4000 calculates the following quantities:
 Quantity   
 Description  
hh360-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-4000 FILE the file on which to write the grid=histo360-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-4000 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-4000 calculates the following quantities:
 Quantity   
 Description  
ff360-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-4000 FILE the file on which to write the grid=fes360-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-5000 calculates the following quantities:
 Quantity   
 Description  
weights360-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-5000 calculates the following quantities:
 Quantity   
 Description  
hh360-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-5000 FILE the file on which to write the grid=histo360-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-5000 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-5000 calculates the following quantities:
 Quantity   
 Description  
ff360-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-5000 FILE the file on which to write the grid=fes360-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-6000 calculates the following quantities:
 Quantity   
 Description  
weights360-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-6000 calculates the following quantities:
 Quantity   
 Description  
hh360-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-6000 FILE the file on which to write the grid=histo360-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-6000 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-6000 calculates the following quantities:
 Quantity   
 Description  
ff360-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-6000 FILE the file on which to write the grid=fes360-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-7000 calculates the following quantities:
 Quantity   
 Description  
weights360-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-7000 calculates the following quantities:
 Quantity   
 Description  
hh360-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-7000 FILE the file on which to write the grid=histo360-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-7000 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-7000 calculates the following quantities:
 Quantity   
 Description  
ff360-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-7000 FILE the file on which to write the grid=fes360-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-8000 calculates the following quantities:
 Quantity   
 Description  
weights360-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-8000 calculates the following quantities:
 Quantity   
 Description  
hh360-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-8000 FILE the file on which to write the grid=histo360-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-8000 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-8000 calculates the following quantities:
 Quantity   
 Description  
ff360-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-8000 FILE the file on which to write the grid=fes360-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-9000 calculates the following quantities:
 Quantity   
 Description  
weights360-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-9000 calculates the following quantities:
 Quantity   
 Description  
hh360-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-9000 FILE the file on which to write the grid=histo360-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-9000 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-9000 calculates the following quantities:
 Quantity   
 Description  
ff360-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-9000 FILE the file on which to write the grid=fes360-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights360-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=360.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights360-10000 calculates the following quantities:
 Quantity   
 Description  
weights360-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights360-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh360-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh360-10000 calculates the following quantities:
 Quantity   
 Description  
hh360-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh360-10000 FILE the file on which to write the grid=histo360-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff360-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh360-10000 TEMPthe temperature at which you are operating=360.0
The CONVERT_TO_FES action with label ff360-10000 calculates the following quantities:
 Quantity   
 Description  
ff360-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff360-10000 FILE the file on which to write the grid=fes360-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-0 calculates the following quantities:
 Quantity   
 Description  
weights370-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-0 calculates the following quantities:
 Quantity   
 Description  
hh370-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-0 FILE the file on which to write the grid=histo370-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-0 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-0 calculates the following quantities:
 Quantity   
 Description  
ff370-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-0 FILE the file on which to write the grid=fes370-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-1000 calculates the following quantities:
 Quantity   
 Description  
weights370-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-1000 calculates the following quantities:
 Quantity   
 Description  
hh370-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-1000 FILE the file on which to write the grid=histo370-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-1000 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-1000 calculates the following quantities:
 Quantity   
 Description  
ff370-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-1000 FILE the file on which to write the grid=fes370-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-2000 calculates the following quantities:
 Quantity   
 Description  
weights370-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-2000 calculates the following quantities:
 Quantity   
 Description  
hh370-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-2000 FILE the file on which to write the grid=histo370-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-2000 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-2000 calculates the following quantities:
 Quantity   
 Description  
ff370-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-2000 FILE the file on which to write the grid=fes370-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-3000 calculates the following quantities:
 Quantity   
 Description  
weights370-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-3000 calculates the following quantities:
 Quantity   
 Description  
hh370-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-3000 FILE the file on which to write the grid=histo370-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-3000 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-3000 calculates the following quantities:
 Quantity   
 Description  
ff370-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-3000 FILE the file on which to write the grid=fes370-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-4000 calculates the following quantities:
 Quantity   
 Description  
weights370-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-4000 calculates the following quantities:
 Quantity   
 Description  
hh370-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-4000 FILE the file on which to write the grid=histo370-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-4000 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-4000 calculates the following quantities:
 Quantity   
 Description  
ff370-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-4000 FILE the file on which to write the grid=fes370-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-5000 calculates the following quantities:
 Quantity   
 Description  
weights370-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-5000 calculates the following quantities:
 Quantity   
 Description  
hh370-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-5000 FILE the file on which to write the grid=histo370-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-5000 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-5000 calculates the following quantities:
 Quantity   
 Description  
ff370-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-5000 FILE the file on which to write the grid=fes370-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-6000 calculates the following quantities:
 Quantity   
 Description  
weights370-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-6000 calculates the following quantities:
 Quantity   
 Description  
hh370-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-6000 FILE the file on which to write the grid=histo370-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-6000 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-6000 calculates the following quantities:
 Quantity   
 Description  
ff370-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-6000 FILE the file on which to write the grid=fes370-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-7000 calculates the following quantities:
 Quantity   
 Description  
weights370-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-7000 calculates the following quantities:
 Quantity   
 Description  
hh370-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-7000 FILE the file on which to write the grid=histo370-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-7000 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-7000 calculates the following quantities:
 Quantity   
 Description  
ff370-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-7000 FILE the file on which to write the grid=fes370-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-8000 calculates the following quantities:
 Quantity   
 Description  
weights370-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-8000 calculates the following quantities:
 Quantity   
 Description  
hh370-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-8000 FILE the file on which to write the grid=histo370-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-8000 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-8000 calculates the following quantities:
 Quantity   
 Description  
ff370-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-8000 FILE the file on which to write the grid=fes370-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-9000 calculates the following quantities:
 Quantity   
 Description  
weights370-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-9000 calculates the following quantities:
 Quantity   
 Description  
hh370-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-9000 FILE the file on which to write the grid=histo370-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-9000 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-9000 calculates the following quantities:
 Quantity   
 Description  
ff370-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-9000 FILE the file on which to write the grid=fes370-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights370-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=370.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights370-10000 calculates the following quantities:
 Quantity   
 Description  
weights370-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights370-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh370-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh370-10000 calculates the following quantities:
 Quantity   
 Description  
hh370-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh370-10000 FILE the file on which to write the grid=histo370-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff370-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh370-10000 TEMPthe temperature at which you are operating=370.0
The CONVERT_TO_FES action with label ff370-10000 calculates the following quantities:
 Quantity   
 Description  
ff370-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff370-10000 FILE the file on which to write the grid=fes370-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-0 calculates the following quantities:
 Quantity   
 Description  
weights380-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-0 calculates the following quantities:
 Quantity   
 Description  
hh380-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-0 FILE the file on which to write the grid=histo380-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-0 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-0 calculates the following quantities:
 Quantity   
 Description  
ff380-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-0 FILE the file on which to write the grid=fes380-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-1000 calculates the following quantities:
 Quantity   
 Description  
weights380-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-1000 calculates the following quantities:
 Quantity   
 Description  
hh380-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-1000 FILE the file on which to write the grid=histo380-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-1000 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-1000 calculates the following quantities:
 Quantity   
 Description  
ff380-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-1000 FILE the file on which to write the grid=fes380-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-2000 calculates the following quantities:
 Quantity   
 Description  
weights380-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-2000 calculates the following quantities:
 Quantity   
 Description  
hh380-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-2000 FILE the file on which to write the grid=histo380-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-2000 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-2000 calculates the following quantities:
 Quantity   
 Description  
ff380-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-2000 FILE the file on which to write the grid=fes380-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-3000 calculates the following quantities:
 Quantity   
 Description  
weights380-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-3000 calculates the following quantities:
 Quantity   
 Description  
hh380-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-3000 FILE the file on which to write the grid=histo380-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-3000 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-3000 calculates the following quantities:
 Quantity   
 Description  
ff380-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-3000 FILE the file on which to write the grid=fes380-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-4000 calculates the following quantities:
 Quantity   
 Description  
weights380-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-4000 calculates the following quantities:
 Quantity   
 Description  
hh380-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-4000 FILE the file on which to write the grid=histo380-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-4000 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-4000 calculates the following quantities:
 Quantity   
 Description  
ff380-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-4000 FILE the file on which to write the grid=fes380-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-5000 calculates the following quantities:
 Quantity   
 Description  
weights380-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-5000 calculates the following quantities:
 Quantity   
 Description  
hh380-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-5000 FILE the file on which to write the grid=histo380-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-5000 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-5000 calculates the following quantities:
 Quantity   
 Description  
ff380-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-5000 FILE the file on which to write the grid=fes380-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-6000 calculates the following quantities:
 Quantity   
 Description  
weights380-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-6000 calculates the following quantities:
 Quantity   
 Description  
hh380-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-6000 FILE the file on which to write the grid=histo380-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-6000 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-6000 calculates the following quantities:
 Quantity   
 Description  
ff380-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-6000 FILE the file on which to write the grid=fes380-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-7000 calculates the following quantities:
 Quantity   
 Description  
weights380-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-7000 calculates the following quantities:
 Quantity   
 Description  
hh380-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-7000 FILE the file on which to write the grid=histo380-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-7000 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-7000 calculates the following quantities:
 Quantity   
 Description  
ff380-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-7000 FILE the file on which to write the grid=fes380-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-8000 calculates the following quantities:
 Quantity   
 Description  
weights380-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-8000 calculates the following quantities:
 Quantity   
 Description  
hh380-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-8000 FILE the file on which to write the grid=histo380-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-8000 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-8000 calculates the following quantities:
 Quantity   
 Description  
ff380-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-8000 FILE the file on which to write the grid=fes380-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-9000 calculates the following quantities:
 Quantity   
 Description  
weights380-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-9000 calculates the following quantities:
 Quantity   
 Description  
hh380-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-9000 FILE the file on which to write the grid=histo380-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-9000 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-9000 calculates the following quantities:
 Quantity   
 Description  
ff380-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-9000 FILE the file on which to write the grid=fes380-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights380-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=380.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights380-10000 calculates the following quantities:
 Quantity   
 Description  
weights380-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights380-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh380-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh380-10000 calculates the following quantities:
 Quantity   
 Description  
hh380-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh380-10000 FILE the file on which to write the grid=histo380-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff380-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh380-10000 TEMPthe temperature at which you are operating=380.0
The CONVERT_TO_FES action with label ff380-10000 calculates the following quantities:
 Quantity   
 Description  
ff380-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff380-10000 FILE the file on which to write the grid=fes380-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-0 calculates the following quantities:
 Quantity   
 Description  
weights390-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-0 calculates the following quantities:
 Quantity   
 Description  
hh390-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-0 FILE the file on which to write the grid=histo390-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-0 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-0 calculates the following quantities:
 Quantity   
 Description  
ff390-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-0 FILE the file on which to write the grid=fes390-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-1000 calculates the following quantities:
 Quantity   
 Description  
weights390-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-1000 calculates the following quantities:
 Quantity   
 Description  
hh390-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-1000 FILE the file on which to write the grid=histo390-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-1000 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-1000 calculates the following quantities:
 Quantity   
 Description  
ff390-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-1000 FILE the file on which to write the grid=fes390-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-2000 calculates the following quantities:
 Quantity   
 Description  
weights390-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-2000 calculates the following quantities:
 Quantity   
 Description  
hh390-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-2000 FILE the file on which to write the grid=histo390-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-2000 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-2000 calculates the following quantities:
 Quantity   
 Description  
ff390-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-2000 FILE the file on which to write the grid=fes390-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-3000 calculates the following quantities:
 Quantity   
 Description  
weights390-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-3000 calculates the following quantities:
 Quantity   
 Description  
hh390-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-3000 FILE the file on which to write the grid=histo390-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-3000 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-3000 calculates the following quantities:
 Quantity   
 Description  
ff390-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-3000 FILE the file on which to write the grid=fes390-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-4000 calculates the following quantities:
 Quantity   
 Description  
weights390-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-4000 calculates the following quantities:
 Quantity   
 Description  
hh390-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-4000 FILE the file on which to write the grid=histo390-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-4000 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-4000 calculates the following quantities:
 Quantity   
 Description  
ff390-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-4000 FILE the file on which to write the grid=fes390-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-5000 calculates the following quantities:
 Quantity   
 Description  
weights390-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-5000 calculates the following quantities:
 Quantity   
 Description  
hh390-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-5000 FILE the file on which to write the grid=histo390-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-5000 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-5000 calculates the following quantities:
 Quantity   
 Description  
ff390-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-5000 FILE the file on which to write the grid=fes390-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-6000 calculates the following quantities:
 Quantity   
 Description  
weights390-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-6000 calculates the following quantities:
 Quantity   
 Description  
hh390-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-6000 FILE the file on which to write the grid=histo390-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-6000 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-6000 calculates the following quantities:
 Quantity   
 Description  
ff390-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-6000 FILE the file on which to write the grid=fes390-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-7000 calculates the following quantities:
 Quantity   
 Description  
weights390-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-7000 calculates the following quantities:
 Quantity   
 Description  
hh390-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-7000 FILE the file on which to write the grid=histo390-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-7000 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-7000 calculates the following quantities:
 Quantity   
 Description  
ff390-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-7000 FILE the file on which to write the grid=fes390-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-8000 calculates the following quantities:
 Quantity   
 Description  
weights390-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-8000 calculates the following quantities:
 Quantity   
 Description  
hh390-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-8000 FILE the file on which to write the grid=histo390-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-8000 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-8000 calculates the following quantities:
 Quantity   
 Description  
ff390-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-8000 FILE the file on which to write the grid=fes390-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-9000 calculates the following quantities:
 Quantity   
 Description  
weights390-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-9000 calculates the following quantities:
 Quantity   
 Description  
hh390-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-9000 FILE the file on which to write the grid=histo390-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-9000 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-9000 calculates the following quantities:
 Quantity   
 Description  
ff390-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-9000 FILE the file on which to write the grid=fes390-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights390-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=390.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights390-10000 calculates the following quantities:
 Quantity   
 Description  
weights390-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights390-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh390-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh390-10000 calculates the following quantities:
 Quantity   
 Description  
hh390-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh390-10000 FILE the file on which to write the grid=histo390-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff390-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh390-10000 TEMPthe temperature at which you are operating=390.0
The CONVERT_TO_FES action with label ff390-10000 calculates the following quantities:
 Quantity   
 Description  
ff390-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff390-10000 FILE the file on which to write the grid=fes390-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-0 calculates the following quantities:
 Quantity   
 Description  
weights400-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-0 calculates the following quantities:
 Quantity   
 Description  
hh400-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-0 FILE the file on which to write the grid=histo400-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-0 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-0 calculates the following quantities:
 Quantity   
 Description  
ff400-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-0 FILE the file on which to write the grid=fes400-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-1000 calculates the following quantities:
 Quantity   
 Description  
weights400-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-1000 calculates the following quantities:
 Quantity   
 Description  
hh400-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-1000 FILE the file on which to write the grid=histo400-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-1000 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-1000 calculates the following quantities:
 Quantity   
 Description  
ff400-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-1000 FILE the file on which to write the grid=fes400-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-2000 calculates the following quantities:
 Quantity   
 Description  
weights400-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-2000 calculates the following quantities:
 Quantity   
 Description  
hh400-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-2000 FILE the file on which to write the grid=histo400-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-2000 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-2000 calculates the following quantities:
 Quantity   
 Description  
ff400-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-2000 FILE the file on which to write the grid=fes400-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-3000 calculates the following quantities:
 Quantity   
 Description  
weights400-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-3000 calculates the following quantities:
 Quantity   
 Description  
hh400-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-3000 FILE the file on which to write the grid=histo400-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-3000 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-3000 calculates the following quantities:
 Quantity   
 Description  
ff400-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-3000 FILE the file on which to write the grid=fes400-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-4000 calculates the following quantities:
 Quantity   
 Description  
weights400-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-4000 calculates the following quantities:
 Quantity   
 Description  
hh400-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-4000 FILE the file on which to write the grid=histo400-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-4000 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-4000 calculates the following quantities:
 Quantity   
 Description  
ff400-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-4000 FILE the file on which to write the grid=fes400-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-5000 calculates the following quantities:
 Quantity   
 Description  
weights400-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-5000 calculates the following quantities:
 Quantity   
 Description  
hh400-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-5000 FILE the file on which to write the grid=histo400-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-5000 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-5000 calculates the following quantities:
 Quantity   
 Description  
ff400-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-5000 FILE the file on which to write the grid=fes400-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-6000 calculates the following quantities:
 Quantity   
 Description  
weights400-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-6000 calculates the following quantities:
 Quantity   
 Description  
hh400-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-6000 FILE the file on which to write the grid=histo400-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-6000 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-6000 calculates the following quantities:
 Quantity   
 Description  
ff400-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-6000 FILE the file on which to write the grid=fes400-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-7000 calculates the following quantities:
 Quantity   
 Description  
weights400-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-7000 calculates the following quantities:
 Quantity   
 Description  
hh400-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-7000 FILE the file on which to write the grid=histo400-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-7000 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-7000 calculates the following quantities:
 Quantity   
 Description  
ff400-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-7000 FILE the file on which to write the grid=fes400-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-8000 calculates the following quantities:
 Quantity   
 Description  
weights400-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-8000 calculates the following quantities:
 Quantity   
 Description  
hh400-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-8000 FILE the file on which to write the grid=histo400-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-8000 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-8000 calculates the following quantities:
 Quantity   
 Description  
ff400-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-8000 FILE the file on which to write the grid=fes400-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-9000 calculates the following quantities:
 Quantity   
 Description  
weights400-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-9000 calculates the following quantities:
 Quantity   
 Description  
hh400-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-9000 FILE the file on which to write the grid=histo400-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-9000 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-9000 calculates the following quantities:
 Quantity   
 Description  
ff400-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-9000 FILE the file on which to write the grid=fes400-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights400-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=400.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights400-10000 calculates the following quantities:
 Quantity   
 Description  
weights400-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights400-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh400-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh400-10000 calculates the following quantities:
 Quantity   
 Description  
hh400-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh400-10000 FILE the file on which to write the grid=histo400-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff400-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh400-10000 TEMPthe temperature at which you are operating=400.0
The CONVERT_TO_FES action with label ff400-10000 calculates the following quantities:
 Quantity   
 Description  
ff400-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff400-10000 FILE the file on which to write the grid=fes400-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-0 calculates the following quantities:
 Quantity   
 Description  
weights410-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-0 calculates the following quantities:
 Quantity   
 Description  
hh410-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-0 FILE the file on which to write the grid=histo410-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-0 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-0 calculates the following quantities:
 Quantity   
 Description  
ff410-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-0 FILE the file on which to write the grid=fes410-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-1000 calculates the following quantities:
 Quantity   
 Description  
weights410-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-1000 calculates the following quantities:
 Quantity   
 Description  
hh410-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-1000 FILE the file on which to write the grid=histo410-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-1000 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-1000 calculates the following quantities:
 Quantity   
 Description  
ff410-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-1000 FILE the file on which to write the grid=fes410-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-2000 calculates the following quantities:
 Quantity   
 Description  
weights410-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-2000 calculates the following quantities:
 Quantity   
 Description  
hh410-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-2000 FILE the file on which to write the grid=histo410-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-2000 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-2000 calculates the following quantities:
 Quantity   
 Description  
ff410-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-2000 FILE the file on which to write the grid=fes410-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-3000 calculates the following quantities:
 Quantity   
 Description  
weights410-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-3000 calculates the following quantities:
 Quantity   
 Description  
hh410-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-3000 FILE the file on which to write the grid=histo410-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-3000 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-3000 calculates the following quantities:
 Quantity   
 Description  
ff410-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-3000 FILE the file on which to write the grid=fes410-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-4000 calculates the following quantities:
 Quantity   
 Description  
weights410-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-4000 calculates the following quantities:
 Quantity   
 Description  
hh410-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-4000 FILE the file on which to write the grid=histo410-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-4000 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-4000 calculates the following quantities:
 Quantity   
 Description  
ff410-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-4000 FILE the file on which to write the grid=fes410-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-5000 calculates the following quantities:
 Quantity   
 Description  
weights410-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-5000 calculates the following quantities:
 Quantity   
 Description  
hh410-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-5000 FILE the file on which to write the grid=histo410-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-5000 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-5000 calculates the following quantities:
 Quantity   
 Description  
ff410-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-5000 FILE the file on which to write the grid=fes410-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-6000 calculates the following quantities:
 Quantity   
 Description  
weights410-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-6000 calculates the following quantities:
 Quantity   
 Description  
hh410-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-6000 FILE the file on which to write the grid=histo410-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-6000 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-6000 calculates the following quantities:
 Quantity   
 Description  
ff410-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-6000 FILE the file on which to write the grid=fes410-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-7000 calculates the following quantities:
 Quantity   
 Description  
weights410-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-7000 calculates the following quantities:
 Quantity   
 Description  
hh410-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-7000 FILE the file on which to write the grid=histo410-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-7000 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-7000 calculates the following quantities:
 Quantity   
 Description  
ff410-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-7000 FILE the file on which to write the grid=fes410-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-8000 calculates the following quantities:
 Quantity   
 Description  
weights410-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-8000 calculates the following quantities:
 Quantity   
 Description  
hh410-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-8000 FILE the file on which to write the grid=histo410-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-8000 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-8000 calculates the following quantities:
 Quantity   
 Description  
ff410-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-8000 FILE the file on which to write the grid=fes410-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-9000 calculates the following quantities:
 Quantity   
 Description  
weights410-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-9000 calculates the following quantities:
 Quantity   
 Description  
hh410-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-9000 FILE the file on which to write the grid=histo410-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-9000 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-9000 calculates the following quantities:
 Quantity   
 Description  
ff410-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-9000 FILE the file on which to write the grid=fes410-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights410-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=410.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights410-10000 calculates the following quantities:
 Quantity   
 Description  
weights410-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights410-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh410-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh410-10000 calculates the following quantities:
 Quantity   
 Description  
hh410-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh410-10000 FILE the file on which to write the grid=histo410-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff410-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh410-10000 TEMPthe temperature at which you are operating=410.0
The CONVERT_TO_FES action with label ff410-10000 calculates the following quantities:
 Quantity   
 Description  
ff410-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff410-10000 FILE the file on which to write the grid=fes410-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-0 calculates the following quantities:
 Quantity   
 Description  
weights420-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-0 calculates the following quantities:
 Quantity   
 Description  
hh420-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-0 FILE the file on which to write the grid=histo420-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-0 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-0 calculates the following quantities:
 Quantity   
 Description  
ff420-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-0 FILE the file on which to write the grid=fes420-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-1000 calculates the following quantities:
 Quantity   
 Description  
weights420-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-1000 calculates the following quantities:
 Quantity   
 Description  
hh420-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-1000 FILE the file on which to write the grid=histo420-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-1000 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-1000 calculates the following quantities:
 Quantity   
 Description  
ff420-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-1000 FILE the file on which to write the grid=fes420-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-2000 calculates the following quantities:
 Quantity   
 Description  
weights420-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-2000 calculates the following quantities:
 Quantity   
 Description  
hh420-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-2000 FILE the file on which to write the grid=histo420-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-2000 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-2000 calculates the following quantities:
 Quantity   
 Description  
ff420-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-2000 FILE the file on which to write the grid=fes420-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-3000 calculates the following quantities:
 Quantity   
 Description  
weights420-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-3000 calculates the following quantities:
 Quantity   
 Description  
hh420-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-3000 FILE the file on which to write the grid=histo420-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-3000 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-3000 calculates the following quantities:
 Quantity   
 Description  
ff420-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-3000 FILE the file on which to write the grid=fes420-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-4000 calculates the following quantities:
 Quantity   
 Description  
weights420-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-4000 calculates the following quantities:
 Quantity   
 Description  
hh420-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-4000 FILE the file on which to write the grid=histo420-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-4000 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-4000 calculates the following quantities:
 Quantity   
 Description  
ff420-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-4000 FILE the file on which to write the grid=fes420-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-5000 calculates the following quantities:
 Quantity   
 Description  
weights420-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-5000 calculates the following quantities:
 Quantity   
 Description  
hh420-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-5000 FILE the file on which to write the grid=histo420-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-5000 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-5000 calculates the following quantities:
 Quantity   
 Description  
ff420-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-5000 FILE the file on which to write the grid=fes420-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-6000 calculates the following quantities:
 Quantity   
 Description  
weights420-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-6000 calculates the following quantities:
 Quantity   
 Description  
hh420-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-6000 FILE the file on which to write the grid=histo420-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-6000 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-6000 calculates the following quantities:
 Quantity   
 Description  
ff420-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-6000 FILE the file on which to write the grid=fes420-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-7000 calculates the following quantities:
 Quantity   
 Description  
weights420-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-7000 calculates the following quantities:
 Quantity   
 Description  
hh420-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-7000 FILE the file on which to write the grid=histo420-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-7000 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-7000 calculates the following quantities:
 Quantity   
 Description  
ff420-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-7000 FILE the file on which to write the grid=fes420-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-8000 calculates the following quantities:
 Quantity   
 Description  
weights420-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-8000 calculates the following quantities:
 Quantity   
 Description  
hh420-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-8000 FILE the file on which to write the grid=histo420-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-8000 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-8000 calculates the following quantities:
 Quantity   
 Description  
ff420-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-8000 FILE the file on which to write the grid=fes420-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-9000 calculates the following quantities:
 Quantity   
 Description  
weights420-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-9000 calculates the following quantities:
 Quantity   
 Description  
hh420-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-9000 FILE the file on which to write the grid=histo420-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-9000 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-9000 calculates the following quantities:
 Quantity   
 Description  
ff420-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-9000 FILE the file on which to write the grid=fes420-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights420-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=420.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights420-10000 calculates the following quantities:
 Quantity   
 Description  
weights420-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights420-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh420-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh420-10000 calculates the following quantities:
 Quantity   
 Description  
hh420-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh420-10000 FILE the file on which to write the grid=histo420-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff420-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh420-10000 TEMPthe temperature at which you are operating=420.0
The CONVERT_TO_FES action with label ff420-10000 calculates the following quantities:
 Quantity   
 Description  
ff420-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff420-10000 FILE the file on which to write the grid=fes420-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-0 calculates the following quantities:
 Quantity   
 Description  
weights430-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-0 calculates the following quantities:
 Quantity   
 Description  
hh430-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-0 FILE the file on which to write the grid=histo430-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-0 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-0 calculates the following quantities:
 Quantity   
 Description  
ff430-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-0 FILE the file on which to write the grid=fes430-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-1000 calculates the following quantities:
 Quantity   
 Description  
weights430-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-1000 calculates the following quantities:
 Quantity   
 Description  
hh430-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-1000 FILE the file on which to write the grid=histo430-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-1000 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-1000 calculates the following quantities:
 Quantity   
 Description  
ff430-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-1000 FILE the file on which to write the grid=fes430-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-2000 calculates the following quantities:
 Quantity   
 Description  
weights430-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-2000 calculates the following quantities:
 Quantity   
 Description  
hh430-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-2000 FILE the file on which to write the grid=histo430-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-2000 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-2000 calculates the following quantities:
 Quantity   
 Description  
ff430-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-2000 FILE the file on which to write the grid=fes430-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-3000 calculates the following quantities:
 Quantity   
 Description  
weights430-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-3000 calculates the following quantities:
 Quantity   
 Description  
hh430-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-3000 FILE the file on which to write the grid=histo430-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-3000 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-3000 calculates the following quantities:
 Quantity   
 Description  
ff430-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-3000 FILE the file on which to write the grid=fes430-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-4000 calculates the following quantities:
 Quantity   
 Description  
weights430-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-4000 calculates the following quantities:
 Quantity   
 Description  
hh430-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-4000 FILE the file on which to write the grid=histo430-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-4000 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-4000 calculates the following quantities:
 Quantity   
 Description  
ff430-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-4000 FILE the file on which to write the grid=fes430-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-5000 calculates the following quantities:
 Quantity   
 Description  
weights430-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-5000 calculates the following quantities:
 Quantity   
 Description  
hh430-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-5000 FILE the file on which to write the grid=histo430-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-5000 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-5000 calculates the following quantities:
 Quantity   
 Description  
ff430-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-5000 FILE the file on which to write the grid=fes430-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-6000 calculates the following quantities:
 Quantity   
 Description  
weights430-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-6000 calculates the following quantities:
 Quantity   
 Description  
hh430-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-6000 FILE the file on which to write the grid=histo430-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-6000 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-6000 calculates the following quantities:
 Quantity   
 Description  
ff430-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-6000 FILE the file on which to write the grid=fes430-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-7000 calculates the following quantities:
 Quantity   
 Description  
weights430-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-7000 calculates the following quantities:
 Quantity   
 Description  
hh430-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-7000 FILE the file on which to write the grid=histo430-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-7000 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-7000 calculates the following quantities:
 Quantity   
 Description  
ff430-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-7000 FILE the file on which to write the grid=fes430-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-8000 calculates the following quantities:
 Quantity   
 Description  
weights430-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-8000 calculates the following quantities:
 Quantity   
 Description  
hh430-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-8000 FILE the file on which to write the grid=histo430-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-8000 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-8000 calculates the following quantities:
 Quantity   
 Description  
ff430-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-8000 FILE the file on which to write the grid=fes430-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-9000 calculates the following quantities:
 Quantity   
 Description  
weights430-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-9000 calculates the following quantities:
 Quantity   
 Description  
hh430-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-9000 FILE the file on which to write the grid=histo430-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-9000 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-9000 calculates the following quantities:
 Quantity   
 Description  
ff430-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-9000 FILE the file on which to write the grid=fes430-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights430-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=430.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights430-10000 calculates the following quantities:
 Quantity   
 Description  
weights430-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights430-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh430-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh430-10000 calculates the following quantities:
 Quantity   
 Description  
hh430-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh430-10000 FILE the file on which to write the grid=histo430-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff430-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh430-10000 TEMPthe temperature at which you are operating=430.0
The CONVERT_TO_FES action with label ff430-10000 calculates the following quantities:
 Quantity   
 Description  
ff430-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff430-10000 FILE the file on which to write the grid=fes430-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-0 calculates the following quantities:
 Quantity   
 Description  
weights440-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-0 calculates the following quantities:
 Quantity   
 Description  
hh440-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-0 FILE the file on which to write the grid=histo440-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-0 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-0 calculates the following quantities:
 Quantity   
 Description  
ff440-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-0 FILE the file on which to write the grid=fes440-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-1000 calculates the following quantities:
 Quantity   
 Description  
weights440-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-1000 calculates the following quantities:
 Quantity   
 Description  
hh440-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-1000 FILE the file on which to write the grid=histo440-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-1000 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-1000 calculates the following quantities:
 Quantity   
 Description  
ff440-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-1000 FILE the file on which to write the grid=fes440-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-2000 calculates the following quantities:
 Quantity   
 Description  
weights440-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-2000 calculates the following quantities:
 Quantity   
 Description  
hh440-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-2000 FILE the file on which to write the grid=histo440-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-2000 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-2000 calculates the following quantities:
 Quantity   
 Description  
ff440-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-2000 FILE the file on which to write the grid=fes440-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-3000 calculates the following quantities:
 Quantity   
 Description  
weights440-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-3000 calculates the following quantities:
 Quantity   
 Description  
hh440-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-3000 FILE the file on which to write the grid=histo440-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-3000 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-3000 calculates the following quantities:
 Quantity   
 Description  
ff440-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-3000 FILE the file on which to write the grid=fes440-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-4000 calculates the following quantities:
 Quantity   
 Description  
weights440-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-4000 calculates the following quantities:
 Quantity   
 Description  
hh440-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-4000 FILE the file on which to write the grid=histo440-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-4000 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-4000 calculates the following quantities:
 Quantity   
 Description  
ff440-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-4000 FILE the file on which to write the grid=fes440-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-5000 calculates the following quantities:
 Quantity   
 Description  
weights440-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-5000 calculates the following quantities:
 Quantity   
 Description  
hh440-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-5000 FILE the file on which to write the grid=histo440-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-5000 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-5000 calculates the following quantities:
 Quantity   
 Description  
ff440-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-5000 FILE the file on which to write the grid=fes440-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-6000 calculates the following quantities:
 Quantity   
 Description  
weights440-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-6000 calculates the following quantities:
 Quantity   
 Description  
hh440-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-6000 FILE the file on which to write the grid=histo440-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-6000 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-6000 calculates the following quantities:
 Quantity   
 Description  
ff440-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-6000 FILE the file on which to write the grid=fes440-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-7000 calculates the following quantities:
 Quantity   
 Description  
weights440-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-7000 calculates the following quantities:
 Quantity   
 Description  
hh440-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-7000 FILE the file on which to write the grid=histo440-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-7000 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-7000 calculates the following quantities:
 Quantity   
 Description  
ff440-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-7000 FILE the file on which to write the grid=fes440-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-8000 calculates the following quantities:
 Quantity   
 Description  
weights440-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-8000 calculates the following quantities:
 Quantity   
 Description  
hh440-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-8000 FILE the file on which to write the grid=histo440-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-8000 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-8000 calculates the following quantities:
 Quantity   
 Description  
ff440-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-8000 FILE the file on which to write the grid=fes440-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-9000 calculates the following quantities:
 Quantity   
 Description  
weights440-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-9000 calculates the following quantities:
 Quantity   
 Description  
hh440-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-9000 FILE the file on which to write the grid=histo440-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-9000 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-9000 calculates the following quantities:
 Quantity   
 Description  
ff440-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-9000 FILE the file on which to write the grid=fes440-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights440-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=440.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights440-10000 calculates the following quantities:
 Quantity   
 Description  
weights440-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights440-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh440-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh440-10000 calculates the following quantities:
 Quantity   
 Description  
hh440-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh440-10000 FILE the file on which to write the grid=histo440-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff440-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh440-10000 TEMPthe temperature at which you are operating=440.0
The CONVERT_TO_FES action with label ff440-10000 calculates the following quantities:
 Quantity   
 Description  
ff440-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff440-10000 FILE the file on which to write the grid=fes440-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-0: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=0.0 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-0 calculates the following quantities:
 Quantity   
 Description  
weights450-0.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-0
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-0
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-0 calculates the following quantities:
 Quantity   
 Description  
hh450-0.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-0 FILE the file on which to write the grid=histo450-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-0: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-0 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-0 calculates the following quantities:
 Quantity   
 Description  
ff450-0.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-0 FILE the file on which to write the grid=fes450-0 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-1000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=60.22140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-1000 calculates the following quantities:
 Quantity   
 Description  
weights450-1000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-1000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-1000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-1000 calculates the following quantities:
 Quantity   
 Description  
hh450-1000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-1000 FILE the file on which to write the grid=histo450-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-1000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-1000 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-1000 calculates the following quantities:
 Quantity   
 Description  
ff450-1000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-1000 FILE the file on which to write the grid=fes450-1000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-2000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=120.44281714 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-2000 calculates the following quantities:
 Quantity   
 Description  
weights450-2000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-2000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-2000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-2000 calculates the following quantities:
 Quantity   
 Description  
hh450-2000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-2000 FILE the file on which to write the grid=histo450-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-2000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-2000 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-2000 calculates the following quantities:
 Quantity   
 Description  
ff450-2000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-2000 FILE the file on which to write the grid=fes450-2000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-3000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=180.66422571 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-3000 calculates the following quantities:
 Quantity   
 Description  
weights450-3000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-3000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-3000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-3000 calculates the following quantities:
 Quantity   
 Description  
hh450-3000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-3000 FILE the file on which to write the grid=histo450-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-3000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-3000 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-3000 calculates the following quantities:
 Quantity   
 Description  
ff450-3000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-3000 FILE the file on which to write the grid=fes450-3000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-4000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=240.88563428 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-4000 calculates the following quantities:
 Quantity   
 Description  
weights450-4000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-4000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-4000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-4000 calculates the following quantities:
 Quantity   
 Description  
hh450-4000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-4000 FILE the file on which to write the grid=histo450-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-4000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-4000 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-4000 calculates the following quantities:
 Quantity   
 Description  
ff450-4000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-4000 FILE the file on which to write the grid=fes450-4000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-5000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=301.10704285 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-5000 calculates the following quantities:
 Quantity   
 Description  
weights450-5000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-5000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-5000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-5000 calculates the following quantities:
 Quantity   
 Description  
hh450-5000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-5000 FILE the file on which to write the grid=histo450-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-5000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-5000 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-5000 calculates the following quantities:
 Quantity   
 Description  
ff450-5000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-5000 FILE the file on which to write the grid=fes450-5000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-6000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=361.32845142 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-6000 calculates the following quantities:
 Quantity   
 Description  
weights450-6000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-6000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-6000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-6000 calculates the following quantities:
 Quantity   
 Description  
hh450-6000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-6000 FILE the file on which to write the grid=histo450-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-6000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-6000 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-6000 calculates the following quantities:
 Quantity   
 Description  
ff450-6000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-6000 FILE the file on which to write the grid=fes450-6000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-7000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=421.54985999 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-7000 calculates the following quantities:
 Quantity   
 Description  
weights450-7000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-7000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-7000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-7000 calculates the following quantities:
 Quantity   
 Description  
hh450-7000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-7000 FILE the file on which to write the grid=histo450-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-7000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-7000 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-7000 calculates the following quantities:
 Quantity   
 Description  
ff450-7000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-7000 FILE the file on which to write the grid=fes450-7000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-8000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=481.77126856 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-8000 calculates the following quantities:
 Quantity   
 Description  
weights450-8000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-8000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-8000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-8000 calculates the following quantities:
 Quantity   
 Description  
hh450-8000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-8000 FILE the file on which to write the grid=histo450-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-8000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-8000 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-8000 calculates the following quantities:
 Quantity   
 Description  
ff450-8000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-8000 FILE the file on which to write the grid=fes450-8000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-9000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=541.9926771300001 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-9000 calculates the following quantities:
 Quantity   
 Description  
weights450-9000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-9000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-9000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-9000 calculates the following quantities:
 Quantity   
 Description  
hh450-9000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-9000 FILE the file on which to write the grid=histo450-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-9000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-9000 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-9000 calculates the following quantities:
 Quantity   
 Description  
ff450-9000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-9000 FILE the file on which to write the grid=fes450-9000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f

weights450-10000: REWEIGHT_TEMP_PRESSCalculate weights for ensemble averages at temperatures and/or pressures different than those used in your original simulation. More details TEMPthe system temperature=400 PRESSUREThe system pressure=301.10704285 REWEIGHT_TEMPReweighting temperature=450.0 REWEIGHT_PRESSUREReweighting pressure=602.2140857 ENERGYEnergy=renergy VOLUMEVolume=vol
The REWEIGHT_TEMP_PRESS action with label weights450-10000 calculates the following quantities:
 Quantity   
 Description  
weights450-10000.value
the weight to use for this frame to determine its contribution at a different temperature/pressureHISTOGRAMAccumulate the average probability density along a few CVs from a trajectory. More details ...
  ARGthe quantities that are being used to construct the histogram=refcv.morethan
  GRID_MIN the lower bounds for the grid=-0.5
  GRID_MAX the upper bounds for the grid=250.5
  GRID_BINthe number of bins for the grid=1000
  BANDWIDTHthe bandwidths for kernel density esimtation=1.
  LOGWEIGHTSthe logarithm of the quantity to use as the weights when calculating averages=weights,weights450-10000
  NORMALIZATION This controls how the data is normalized it can be set equal to true, false or ndata=true
  LABELa label for the action so that its output can be referenced in the input to other actions=hh450-10000
  CLEAR the frequency with whihc to clear the data that is being averaged=10000
... HISTOGRAM

The HISTOGRAM action with label hh450-10000 calculates the following quantities:
 Quantity   
 Description  
hh450-10000.value
the estimate of the histogram as a function of the argument that was obtainedDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=hh450-10000 FILE the file on which to write the grid=histo450-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f
ff450-10000: CONVERT_TO_FESConvert a histogram to a free energy surface. More details GRIDthe histogram that you would like to convert into a free energy surface (old syntax)=hh450-10000 TEMPthe temperature at which you are operating=450.0
The CONVERT_TO_FES action with label ff450-10000 calculates the following quantities:
 Quantity   
 Description  
ff450-10000.value
the free energy surfaceDUMPGRIDOutput the function on the grid to a file with the PLUMED grid format. More details GRIDthe grid you would like to print (can also use ARG for specifying what is being printed)=ff450-10000 FILE the file on which to write the grid=fes450-10000 STRIDE the frequency with which the grid should be output to the file=10000 FMTthe format that should be used to output real numbers=%16.10f


PRINTPrint quantities to a file. More details ARGthe labels of the values that you would like to print to the file=* FILEthe name of the file on which to output these quantities=COLVAR STRIDE the frequency with which the quantities of interest should be output=1 FMTthe format that should be used to output real numbers=%16.10f