Utility functions ================= To simplify some tasks, the library interface contains these utility functions. They do not directly call the LAMMPS library. - :cpp:func:`lammps_encode_image_flags` - :cpp:func:`lammps_decode_image_flags` - :cpp:func:`lammps_set_fix_external_callback` - :cpp:func:`lammps_fix_external_set_energy_global` - :cpp:func:`lammps_fix_external_set_energy_peratom` - :cpp:func:`lammps_fix_external_set_virial_global` - :cpp:func:`lammps_fix_external_set_virial_peratom` - :cpp:func:`lammps_fix_external_set_vector_length` - :cpp:func:`lammps_fix_external_set_vector` - :cpp:func:`lammps_flush_buffers` - :cpp:func:`lammps_free` - :cpp:func:`lammps_is_running` - :cpp:func:`lammps_force_timeout` - :cpp:func:`lammps_has_error` - :cpp:func:`lammps_get_last_error_message` The :cpp:func:`lammps_free` function is a clean-up function to free memory that the library had allocated previously via other function calls. Look for notes in the descriptions of the individual commands where such memory buffers were allocated that require the use of :cpp:func:`lammps_free`. ----------------------- .. doxygenfunction:: lammps_encode_image_flags :project: progguide ----------------------- .. doxygenfunction:: lammps_decode_image_flags(int image, int *flags) :project: progguide ----------------------- .. doxygenfunction:: lammps_set_fix_external_callback(void *, const char *, FixExternalFnPtr, void*) :project: progguide ----------------------- .. doxygenfunction:: lammps_fix_external_set_energy_global :project: progguide ----------------------- .. doxygenfunction:: lammps_fix_external_set_energy_peratom :project: progguide ----------------------- .. doxygenfunction:: lammps_fix_external_set_virial_global :project: progguide ----------------------- .. doxygenfunction:: lammps_fix_external_set_virial_peratom :project: progguide ----------------------- .. doxygenfunction:: lammps_fix_external_set_vector_length :project: progguide ----------------------- .. doxygenfunction:: lammps_fix_external_set_vector :project: progguide ----------------------- .. doxygenfunction:: lammps_flush_buffers :project: progguide ----------------------- .. doxygenfunction:: lammps_free :project: progguide ----------------------- .. doxygenfunction:: lammps_is_running :project: progguide ----------------------- .. doxygenfunction:: lammps_force_timeout :project: progguide ----------------------- .. doxygenfunction:: lammps_has_error :project: progguide ----------------------- .. doxygenfunction:: lammps_get_last_error_message :project: progguide