48aa45f7f0
Resolved Conflicts (i hope): src/REPLICA/neb.cpp src/REPLICA/prd.cpp src/REPLICA/tad.cpp src/REPLICA/verlet_split.cpp src/USER-CUDA/atom_vec_angle_cuda.h src/USER-CUDA/atom_vec_atomic_cuda.h src/USER-CUDA/atom_vec_charge_cuda.h src/USER-CUDA/atom_vec_full_cuda.h src/USER-CUDA/compute_pe_cuda.h src/USER-CUDA/compute_pressure_cuda.h src/USER-CUDA/compute_temp_cuda.h src/USER-CUDA/compute_temp_partial_cuda.h src/USER-CUDA/cuda.cpp src/USER-CUDA/cuda.h src/USER-CUDA/cuda_data.h src/USER-CUDA/cuda_neigh_list.h src/USER-CUDA/fft3d_cuda.h src/USER-CUDA/fft3d_wrap_cuda.h src/USER-CUDA/fix_addforce_cuda.h src/USER-CUDA/fix_aveforce_cuda.h src/USER-CUDA/fix_enforce2d_cuda.h src/USER-CUDA/fix_freeze_cuda.h src/USER-CUDA/fix_gravity_cuda.h src/USER-CUDA/fix_nve_cuda.h src/USER-CUDA/fix_set_force_cuda.h src/USER-CUDA/fix_temp_berendsen_cuda.h src/USER-CUDA/fix_temp_rescale_cuda.h src/USER-CUDA/fix_temp_rescale_limit_cuda.h src/USER-CUDA/fix_viscous_cuda.h src/USER-CUDA/pair_born_coul_long_cuda.h src/USER-CUDA/pair_buck_coul_cut_cuda.h src/USER-CUDA/pair_buck_coul_long_cuda.h src/USER-CUDA/pair_buck_cuda.h src/USER-CUDA/pair_cg_cmm_coul_cut_cuda.cpp src/USER-CUDA/pair_cg_cmm_coul_cut_cuda.h src/USER-CUDA/pair_cg_cmm_coul_debye_cuda.cpp src/USER-CUDA/pair_cg_cmm_coul_debye_cuda.h src/USER-CUDA/pair_cg_cmm_coul_long_cuda.cpp src/USER-CUDA/pair_cg_cmm_coul_long_cuda.h src/USER-CUDA/pair_cg_cmm_cuda.cpp src/USER-CUDA/pair_cg_cmm_cuda.h src/USER-CUDA/pair_eam_cuda.h src/USER-CUDA/pair_gran_hooke_cuda.h src/USER-CUDA/pair_lj96_cut_cuda.h src/USER-CUDA/pair_lj_charmm_coul_charmm_cuda.h src/USER-CUDA/pair_lj_charmm_coul_charmm_implicit_cuda.h src/USER-CUDA/pair_lj_charmm_coul_long_cuda.h src/USER-CUDA/pair_lj_class2_coul_cut_cuda.h src/USER-CUDA/pair_lj_class2_coul_long_cuda.h src/USER-CUDA/pair_lj_class2_cuda.h src/USER-CUDA/pair_lj_cut_coul_cut_cuda.h src/USER-CUDA/pair_lj_cut_coul_debye_cuda.h src/USER-CUDA/pair_lj_cut_coul_long_cuda.h src/USER-CUDA/pair_lj_cut_cuda.h src/USER-CUDA/pair_lj_cut_experimental_cuda.h src/USER-CUDA/pair_lj_expand_cuda.h src/USER-CUDA/pair_lj_gromacs_coul_gromacs_cuda.h src/USER-CUDA/pair_lj_gromacs_cuda.h src/USER-CUDA/pair_lj_sdk_coul_long_cuda.cpp src/USER-CUDA/pair_lj_sdk_coul_long_cuda.h src/USER-CUDA/pair_lj_sdk_cuda.h src/USER-CUDA/pair_lj_smooth_cuda.h src/USER-CUDA/pair_morse_cuda.h src/USER-CUDA/pair_sw_cuda.h src/USER-CUDA/pair_tersoff_cuda.h src/USER-CUDA/pair_tersoff_zbl_cuda.h src/USER-CUDA/pppm_cuda.h src/USER-CUDA/verlet_cuda.cpp src/USER-CUDA/verlet_cuda.h src/comm.cpp src/finish.cpp src/fix_rigid_nvt.h src/respa.cpp src/run.cpp
88 lines
2.5 KiB
C++
88 lines
2.5 KiB
C++
/* -*- c++ -*- ----------------------------------------------------------
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LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
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http://lammps.sandia.gov, Sandia National Laboratories
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Steve Plimpton, sjplimp@sandia.gov
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Copyright (2003) Sandia Corporation. Under the terms of Contract
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DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
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certain rights in this software. This software is distributed under
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the GNU General Public License.
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See the README file in the top-level LAMMPS directory.
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------------------------------------------------------------------------- */
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#ifdef COMMAND_CLASS
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CommandStyle(delete_bonds,DeleteBonds)
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#else
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#ifndef LMP_DELETE_BONDS_H
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#define LMP_DELETE_BONDS_H
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#include "pointers.h"
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namespace LAMMPS_NS {
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class DeleteBonds : protected Pointers {
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public:
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DeleteBonds(class LAMMPS *);
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void command(int, char **);
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};
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}
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#endif
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#endif
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/* ERROR/WARNING messages:
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E: Delete_bonds command before simulation box is defined
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The delete_bonds command cannot be used before a read_data,
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read_restart, or create_box command.
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E: Delete_bonds command with no atoms existing
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No atoms are yet defined so the delete_bonds command cannot be used.
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E: Cannot use delete_bonds with non-molecular system
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Your choice of atom style does not have bonds.
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E: Illegal ... command
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Self-explanatory. Check the input script syntax and compare to the
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documentation for the command. You can use -echo screen as a
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command-line option when running LAMMPS to see the offending line.
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E: Cannot find delete_bonds group ID
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Group ID used in the delete_bonds command does not exist.
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E: Bond atom missing in delete_bonds
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The delete_bonds command cannot find one or more atoms in a particular
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bond on a particular processor. The pairwise cutoff is too short or
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the atoms are too far apart to make a valid bond.
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E: Angle atom missing in delete_bonds
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The delete_bonds command cannot find one or more atoms in a particular
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angle on a particular processor. The pairwise cutoff is too short or
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the atoms are too far apart to make a valid angle.
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E: Dihedral atom missing in delete_bonds
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The delete_bonds command cannot find one or more atoms in a particular
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dihedral on a particular processor. The pairwise cutoff is too short
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or the atoms are too far apart to make a valid dihedral.
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E: Improper atom missing in delete_bonds
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The delete_bonds command cannot find one or more atoms in a particular
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improper on a particular processor. The pairwise cutoff is too short
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or the atoms are too far apart to make a valid improper.
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*/
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