use argparse in colvars lib build

This commit is contained in:
Axel Kohlmeyer 2018-12-04 17:50:07 -05:00
parent 4e7329151d
commit 3aacea671e
1 changed files with 27 additions and 26 deletions
lib/colvars

View File

@ -5,7 +5,12 @@
from __future__ import print_function
import sys,os,subprocess
sys.path.append('..')
from install_helpers import error,get_cpus
from install_helpers import get_cpus
from argparse import ArgumentParser
parser = ArgumentParser(prog='Install.py',
description="LAMMPS library build wrapper script")
# help message
@ -26,37 +31,33 @@ Examples:
make lib-colvars args="-m mpi" # build COLVARS lib with default mpi compiler wrapper
"""
# parse args
args = sys.argv[1:]
nargs = len(args)
if nargs == 0: error(help=help)
machine = None
extraflag = False
iarg = 0
while iarg < nargs:
if args[iarg] == "-m":
if iarg+2 > len(args): error(help=help)
machine = args[iarg+1]
iarg += 2
elif args[iarg] == "-e":
if iarg+2 > len(args): error(help=help)
extraflag = True
suffix = args[iarg+1]
iarg += 2
else: error(help=help)
# set lib from working dir
cwd = os.getcwd()
lib = os.path.basename(cwd)
# parse and process arguments
parser.add_argument("-m", "--machine",
help="suffix of a <libname>/Makefile.* or of a src/MAKE/MACHINES/Makefile.* file used for compiling this library")
parser.add_argument("-e", "--extramake",
help="set EXTRAMAKE variable in <libname>/Makefile.<machine> to Makefile.lammps.<extramake>")
args = parser.parse_args()
# print help message and exit, if neither build nor path options are given
if not args.machine and not args.extramake:
parser.print_help()
sys.exit(help)
machine = args.machine
extraflag = args.extramake != None
suffix = args.extramake
def get_lammps_machine_flags(machine):
"""Parse Makefile.machine from LAMMPS, return dictionary of compiler flags"""
if not os.path.exists("../../src/MAKE/MACHINES/Makefile.%s" % machine):
error("Cannot locate src/MAKE/MACHINES/Makefile.%s" % machine)
sys.exit("Cannot locate src/MAKE/MACHINES/Makefile.%s" % machine)
lines = open("../../src/MAKE/MACHINES/Makefile.%s" % machine,
'r').readlines()
machine_flags = {}
@ -102,7 +103,7 @@ if not os.path.exists("Makefile.%s" % machine):
machine_flags = get_lammps_machine_flags(machine)
gen_colvars_makefile_machine(machine, machine_flags)
if not os.path.exists("Makefile.%s" % machine):
error("lib/%s/Makefile.%s does not exist" % (lib,machine))
sys.exit("lib/%s/Makefile.%s does not exist" % (lib,machine))
# create Makefile.auto as copy of Makefile.machine
# reset EXTRAMAKE if requested
@ -131,6 +132,6 @@ except subprocess.CalledProcessError as e:
sys.exit(1)
if os.path.exists("lib%s.a" % lib): print("Build was successful")
else: error("Build of lib/%s/lib%s.a was NOT successful" % (lib,lib))
else: sys.exit("Build of lib/%s/lib%s.a was NOT successful" % (lib,lib))
if not os.path.exists("Makefile.lammps"):
print("lib/%s/Makefile.lammps was NOT created" % lib)