(git:b279b6b)
free_energy_methods.F File Reference

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Modules

module  free_energy_methods
 Methods to perform free energy and free energy derivatives calculations.
 

Functions/Subroutines

subroutine, public free_energy_methods::free_energy_evaluate (md_env, converged, fe_section)
 Main driver for free energy calculations In this routine we handle specifically biased MD. More...