Loading src/molecule.cpp +2 −1 Original line number Diff line number Diff line Loading @@ -154,7 +154,8 @@ void Molecule::compute_mass() /* ---------------------------------------------------------------------- compute com = center of mass of molecule could have been set by user, otherwise calculate it NOTE: account for finite size particles? NOTE: does not account for finite size particles user should specify COM if wants that effect also compute: dxcom = displacement of each atom from COM comatom = which atom (1-Natom) is nearest the COM Loading Loading
src/molecule.cpp +2 −1 Original line number Diff line number Diff line Loading @@ -154,7 +154,8 @@ void Molecule::compute_mass() /* ---------------------------------------------------------------------- compute com = center of mass of molecule could have been set by user, otherwise calculate it NOTE: account for finite size particles? NOTE: does not account for finite size particles user should specify COM if wants that effect also compute: dxcom = displacement of each atom from COM comatom = which atom (1-Natom) is nearest the COM Loading
