metadynamics_utils.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	metadynamics_utils
	Performs the metadynamics calculation.

Functions/Subroutines
subroutine, public	metadynamics_utils::metadyn_read (meta_env, force_env, root_section, para_env, fe_section)
	reads metadynamics section More...
subroutine, public	metadynamics_utils::synchronize_multiple_walkers (multiple_walkers, hills_env, colvars, n_colvar, metadyn_section)
	Synchronize with the rest of the walkers. More...
subroutine, public	metadynamics_utils::add_hill_single (hills_env, colvars, ww, n_hills, n_colvar, invdt)
	Add a single Hill. More...
subroutine, public	metadynamics_utils::restart_hills (ss_history, delta_s_history, ww_history, ww, n_hills, n_colvar, colvars, metadyn_section, invdt_history)
	Restart Hills Information. More...
subroutine, public	metadynamics_utils::get_meta_iter_level (meta_env, iter_nr)
	Retrieves the iteration level for the metadynamics loop. More...
subroutine, public	metadynamics_utils::meta_walls (meta_env)
	... More...