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setup.py
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Created
Sat, Aug 17, 19:47
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1 KB
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text/x-python
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Mon, Aug 19, 19:47 (1 d, 23 h)
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rLAMMPS lammps
setup.py
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#!/usr/local/bin/python
"""
setup.py file for LAMMPS with system MPI library
"""
from
distutils.core
import
setup
,
Extension
import
os
,
glob
path
=
os
.
path
.
dirname
(
os
.
getcwd
())
# list of src files for LAMMPS
libfiles
=
glob
.
glob
(
"
%s
/src/*.cpp"
%
path
)
lammps_library
=
Extension
(
"_lammps"
,
sources
=
libfiles
,
define_macros
=
[(
"MPICH_IGNORE_CXX_SEEK"
,
1
),
(
"LAMMPS_GZIP"
,
1
),
(
"FFT_NONE"
,
1
),],
# src files for LAMMPS
include_dirs
=
[
"../src"
],
# additional libs for MPICH on Linux
libraries
=
[
"mpich"
,
"rt"
],
# where to find the MPICH lib on Linux
library_dirs
=
[
"/usr/local/lib"
],
# additional libs for MPI on Mac
# libraries = ["mpi"],
)
setup
(
name
=
"lammps"
,
version
=
"26Oct10"
,
author
=
"Steve Plimpton"
,
author_email
=
"sjplimp@sandia.gov"
,
url
=
"http://lammps.sandia.gov"
,
description
=
"""LAMMPS molecular dynamics library - parallel"""
,
py_modules
=
[
"lammps"
],
ext_modules
=
[
lammps_library
]
)
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