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This commit is contained in:
Axel Kohlmeyer
2023-01-29 13:42:36 -05:00
parent f0578bbf63
commit 370c701f89
3 changed files with 13 additions and 13 deletions
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10
python/lammps/core.py
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@ -217,8 +217,8 @@ class lammps(object):
self.lib.lammps_gather_dihedrals.restype = None
self.lib.lammps_gather_impropers.argtypes = [c_void_p,c_void_p]
self.lib.lammps_gather_impropers.restype = None
self.lib.lammps_gather_impropers.restype = None
self.lib.lammps_gather.argtypes = [c_void_p,c_char_p,c_int,c_int,c_void_p]
self.lib.lammps_gather.restype = None
@ -1330,7 +1330,7 @@ class lammps(object):
return nangles,data
# -------------------------------------------------------------------------
def gather_dihedrals(self):
"""Retrieve global list of dihedrals
@ -1375,8 +1375,8 @@ class lammps(object):
self.lib.lammps_gather_impropers(self.lmp,data)
return nimpropers,data
# -------------------------------------------------------------------------
# -------------------------------------------------------------------------
# return vector of atom/compute/fix properties gathered across procs
# 3 variants to match src/library.cpp
# name = atom property recognized by LAMMPS in atom->extract()