git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13207 f3b2605a-c512-4ea7-a41b-209d697bcdaa

This commit is contained in:
sjplimp
2015-03-09 14:50:53 +00:00
parent 08e77a79b3
commit 5a0a8f1335
11 changed files with 118 additions and 61 deletions

View File

@ -153,8 +153,7 @@ cvm::real colvarbias_restraint::energy_difference(std::string const &conf)
}
if (get_keyval(conf, "centers", alt_colvar_centers, colvar_centers)) {
for (i = 0; i < colvars.size(); i++) {
colvar_centers[i].type(colvars[i]->value());
colvar_centers[i].apply_constraints();
alt_colvar_centers[i].apply_constraints();
}
}