Loading doc/src/reset_mol_ids.rst +9 −0 Original line number Diff line number Diff line Loading @@ -53,6 +53,15 @@ also be useful after molecules have been deleted with the has lost molecules, e.g. via the :doc:`fix evaporate <fix_evaporate>` command. .. note:: The same as explained for the :doc:`compute fragment/atom <compute_cluster_atom>` command, molecules are identified using the current bond topology within each fragment. This will not account for bonds broken by the :doc:`bond_style quartic <bond_quartic>` command because it does not perform a full update of the bond topology data structures within LAMMPS. Restrictions """""""""""" none Loading Loading
doc/src/reset_mol_ids.rst +9 −0 Original line number Diff line number Diff line Loading @@ -53,6 +53,15 @@ also be useful after molecules have been deleted with the has lost molecules, e.g. via the :doc:`fix evaporate <fix_evaporate>` command. .. note:: The same as explained for the :doc:`compute fragment/atom <compute_cluster_atom>` command, molecules are identified using the current bond topology within each fragment. This will not account for bonds broken by the :doc:`bond_style quartic <bond_quartic>` command because it does not perform a full update of the bond topology data structures within LAMMPS. Restrictions """""""""""" none Loading
