From 669793fc2818012bbd60c39882031e92ae5c5f4d Mon Sep 17 00:00:00 2001 From: Gareth Aneurin Tribello Date: Wed, 4 Sep 2024 10:32:16 +0100 Subject: [PATCH] Added missing keywords to MultiColvarDensity --- src/gridtools/MultiColvarDensity.cpp | 2 ++ 1 file changed, 2 insertions(+) diff --git a/src/gridtools/MultiColvarDensity.cpp b/src/gridtools/MultiColvarDensity.cpp index a51b83f557..c3104903fd 100644 --- a/src/gridtools/MultiColvarDensity.cpp +++ b/src/gridtools/MultiColvarDensity.cpp @@ -94,6 +94,8 @@ void MultiColvarDensity::registerKeywords( Keywords& keys ) { keys.add("compulsory","KERNEL","GAUSSIAN","the kernel function you are using. More details on the kernels available " "in plumed plumed can be found in \\ref kernelfunctions."); keys.add("optional","NBINS","the number of bins to use in each direction (alternative to GRID_NBIN)"); + keys.add("optional","GRID_MIN","the lower bounds for the grid (default boxlengths)"); + keys.add("optional","GRID_MAX","the upper bounds for the grid (default boxlengths)"); keys.add("optional","DATA","the multicolvar which you would like to calculate the density profile for"); keys.add("optional","ATOMS","if you are calculating a atomic density you use this keyword to specify the atoms that are involved"); keys.addFlag("UNORMALIZED",false,"do not divide by the density");