Gromacs
2024.4
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#include "gmxpre.h"
#include "topologyhelpers.h"
#include "gromacs/topology/mtop_util.h"
#include "gromacs/topology/topology.h"
Helper functions for topology generation.
Functions | |
void | gmx::test::addNWaterMolecules (gmx_mtop_t *mtop, int numWaters) |
Adds water molecules with settles to topology. More... | |