Add grompp check for usage of "define" field in mdp

[gromacs.git] / docs / release-notes / miscellaneous.rst

Miscellaneous
^^^^^^^^^^^^^

grompp now warns if macros in mdp "define" field are unused in topology
"""""""""""""""""""""""""""""""""""""""""""""""""""""""""""""""""""""""
Macros defined in the mdp (with e.g. -DPOSRES) now cause a warning
in grompp if they are not encountered while parsing the topology file

:issue:`1975`