Files
lammps/src/dihedral_deprecated.cpp
2022-10-24 11:08:26 -04:00

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1.7 KiB
C++

/* ----------------------------------------------------------------------
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
https://www.lammps.org/, Sandia National Laboratories
LAMMPS development team: developers@lammps.org
Copyright (2003) Sandia Corporation. Under the terms of Contract
DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
certain rights in this software. This software is distributed under
the GNU General Public License.
See the README file in the top-level LAMMPS directory.
------------------------------------------------------------------------- */
/* ----------------------------------------------------------------------
Contributing author: Axel Kohlmeyer (Temple U)
------------------------------------------------------------------------- */
#include "dihedral_deprecated.h"
#include "comm.h"
#include "dihedral_hybrid.h"
#include "error.h"
#include "force.h"
using namespace LAMMPS_NS;
/* ---------------------------------------------------------------------- */
void DihedralDeprecated::settings(int, char **)
{
std::string my_style = force->dihedral_style;
// hybrid substyles are created in DihedralHybrid::settings(),
// so when this is called, our style was just added at the end
// of the list of substyles
if (utils::strmatch(my_style, "^hybrid")) {
auto hybrid = dynamic_cast<DihedralHybrid *>(force->dihedral);
my_style = hybrid->keywords[hybrid->nstyles];
}
if (my_style == "DEPRECATED") {
if (lmp->comm->me == 0)
utils::logmesg(lmp, "\nDihedral style 'DEPRECATED' is a dummy style\n\n");
return;
}
error->all(FLERR, "This dihedral style is no longer available");
}