Documentation for module qmmm_links_methods

A collection of methods to treat the QM/MM links

source: qmmm_links_methods.F
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public Subroutines/Functions:

correct the position for added charges in qm/mm link scheme
correct the forces due to the added charges in qm/mm link scheme
correct the position for qm/mm IMOMM link type
correct the forces for qm/mm IMOMM link type

SUBROUTINEqmmm_added_chrg_coord(qmmm_env, particles)

correct the position for added charges in qm/mm link scheme

Arguments:
POINTER
:: qmmm_env ...
POINTER
:: particles(:) ...

SUBROUTINEqmmm_added_chrg_forces(qmmm_env, particles)

correct the forces due to the added charges in qm/mm link scheme

Arguments:
POINTER
:: qmmm_env ...
POINTER
:: particles(:) ...