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(parent: 6fc7218) | patch
Move listed and wall forces out of do_force_lowlevel()
authorBerk Hess <hess@kth.se>
Wed, 2 Sep 2020 21:02:55 +0000 (21:02 +0000)
committerArtem Zhmurov <zhmurov@gmail.com>
Wed, 2 Sep 2020 21:02:55 +0000 (21:02 +0000)
commite1f40a447fb32bdf742d43724f7514f0ad42284a
treeb802a4f9cde78669940177fdc149963018a456e8tree | snapshot
parent6fc7218725f35789a8a3f309bd22ee7b539b3c9bcommit | diff
Move listed and wall forces out of do_force_lowlevel()

Renamed do_force_lowlevel() to calculateLongRangeElectrostatics().

Also replace C pointer for coordinates by ArrayRefWithPadding
in calculate() of ListedForces and do_walls().
src/gromacs/listed_forces/listed_forces.cpp diff | blob | history
src/gromacs/listed_forces/listed_forces.h diff | blob | history
src/gromacs/mdlib/force.cpp diff | blob | history
src/gromacs/mdlib/force.h diff | blob | history
src/gromacs/mdlib/sim_util.cpp diff | blob | history
src/gromacs/mdlib/wall.cpp diff | blob | history
src/gromacs/mdlib/wall.h diff | blob | history
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