This is the complete list of members for
mcpele::MC, including all inherited members.
abort() | mcpele::MC | [inline] |
accept_t typedef | mcpele::MC | |
actions_t typedef | mcpele::MC | |
add_accept_test(std::shared_ptr< AcceptTest > accept_test) | mcpele::MC | [inline] |
add_action(std::shared_ptr< Action > action) | mcpele::MC | [inline] |
add_conf_test(std::shared_ptr< ConfTest > conf_test) | mcpele::MC | [inline] |
add_late_conf_test(std::shared_ptr< ConfTest > conf_test) | mcpele::MC | [inline] |
check_input() | mcpele::MC | |
compute_energy(pele::Array< double > x) | mcpele::MC | [inline, protected] |
conf_t typedef | mcpele::MC | |
do_accept_tests(pele::Array< double > xtrial, double etrial, pele::Array< double > xold, double eold) | mcpele::MC | [protected] |
do_actions(pele::Array< double > x, double energy, bool success) | mcpele::MC | [protected] |
do_conf_tests(pele::Array< double > x) | mcpele::MC | [protected] |
do_late_conf_tests(pele::Array< double > x) | mcpele::MC | [protected] |
get_accepted_fraction() const | mcpele::MC | [inline] |
get_conf_rejection_fraction() const | mcpele::MC | [inline] |
get_coords() const | mcpele::MC | [inline] |
get_E_rejection_fraction() const | mcpele::MC | [inline] |
get_energy() const | mcpele::MC | [inline] |
get_iterations_count() const | mcpele::MC | [inline] |
get_naccept() const | mcpele::MC | [inline] |
get_neval() const | mcpele::MC | [inline] |
get_norm_coords() const | mcpele::MC | [inline] |
get_nreject() const | mcpele::MC | [inline] |
get_potential_ptr() | mcpele::MC | [inline] |
get_report_steps() const | mcpele::MC | [inline] |
get_success() const | mcpele::MC | [inline] |
get_takestep() const | mcpele::MC | [inline] |
get_temperature() const | mcpele::MC | [inline] |
get_trial_coords() const | mcpele::MC | [inline] |
get_trial_energy() const | mcpele::MC | [inline] |
m_accept_count | mcpele::MC | [protected] |
m_accept_tests | mcpele::MC | [protected] |
m_actions | mcpele::MC | [protected] |
m_conf_reject_count | mcpele::MC | [protected] |
m_conf_tests | mcpele::MC | [protected] |
m_coords | mcpele::MC | [protected] |
m_E_reject_count | mcpele::MC | [protected] |
m_energy | mcpele::MC | |
m_late_conf_tests | mcpele::MC | [protected] |
m_neval | mcpele::MC | |
m_niter | mcpele::MC | |
m_nitercount | mcpele::MC | [protected] |
m_potential | mcpele::MC | [protected] |
m_print_progress | mcpele::MC | [protected] |
m_success | mcpele::MC | [protected] |
m_take_step | mcpele::MC | [protected] |
m_temperature | mcpele::MC | |
m_trial_coords | mcpele::MC | [protected] |
m_trial_energy | mcpele::MC | |
MC(std::shared_ptr< pele::BasePotential > potential, pele::Array< double > &coords, const double temperature) | mcpele::MC | |
one_iteration() | mcpele::MC | |
report_steps_specified() const | mcpele::MC | [inline] |
reset_energy() | mcpele::MC | |
run(const size_t max_iter) | mcpele::MC | |
set_coordinates(pele::Array< double > &coords, double energy) | mcpele::MC | |
set_print_progress(const bool input) | mcpele::MC | [inline] |
set_print_progress() | mcpele::MC | [inline] |
set_report_steps(const size_t report_steps) | mcpele::MC | [inline] |
set_takestep(std::shared_ptr< TakeStep > takestep) | mcpele::MC | [inline] |
set_temperature(const double T) | mcpele::MC | [inline] |
take_step_specified() const | mcpele::MC | [inline] |
take_steps() | mcpele::MC | [protected] |
~MC() | mcpele::MC | [inline, virtual] |