qmmmx_force.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	qmmmx_force
	Calculates QM/MM energy and forces with Force-Mixing.

Functions/Subroutines
subroutine, public	qmmmx_force::qmmmx_calc_energy_force (qmmmx_env, calc_force, consistent_energies, linres, require_consistent_energy_force)
	calculates the qm/mm energy and forces