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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15561 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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sjplimp
2016-09-08 20:20:32 +00:00
parent 06b7d56e16
commit b190abea39
439 changed files with 6275 additions and 5739 deletions
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lib/colvars/colvargrid.cpp
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@ -35,13 +35,13 @@ colvar_grid_scalar::colvar_grid_scalar(colvar_grid_scalar const &g)
}
colvar_grid_scalar::colvar_grid_scalar(std::vector<int> const &nx_i)
: colvar_grid<cvm::real>(nx_i, 0.0, 1), samples(NULL)
: colvar_grid<cvm::real>(nx_i, 0.0, 1), samples(NULL), grad(NULL)
{
grad = new cvm::real[nd];
}
colvar_grid_scalar::colvar_grid_scalar(std::vector<colvar *> &colvars, bool margin)
: colvar_grid<cvm::real>(colvars, 0.0, 1, margin), samples(NULL)
: colvar_grid<cvm::real>(colvars, 0.0, 1, margin), samples(NULL), grad(NULL)
{
grad = new cvm::real[nd];
}