mirror of
https://github.com/LCPQ/quantum_package
synced 2024-10-31 19:23:50 +01:00
707 lines
20 KiB
Python
Executable File
707 lines
20 KiB
Python
Executable File
#!/usr/bin/env python
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# -*- coding: utf-8 -*-
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"""
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Usage: qp_create_ninja.py (--development | --production) CONFIG_FILE
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"""
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import os
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import sys
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import glob
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from os.path import join
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from collections import namedtuple
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from collections import defaultdict
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try:
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from module_handler import ModuleHandler
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from read_compilation_cfg import get_compilation_option
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from docopt import docopt
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except ImportError:
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print "source .quantum_package.rc"
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sys.exit(1)
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# __
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# /__ | _ |_ _. | _. ._ o _. |_ | _ _
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# \_| | (_) |_) (_| | \/ (_| | | (_| |_) | (/_ _>
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#
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QPACKAGE_ROOT = os.environ['QPACKAGE_ROOT']
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QPACKAGE_ROOT_SRC = join(QPACKAGE_ROOT, 'src')
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QPACKAGE_ROOT_EZFIO = join(QPACKAGE_ROOT, 'EZFIO')
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EZFIO_LIB = join(QPACKAGE_ROOT_EZFIO, "lib", "libezfio.a")
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#
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# |\ | _. ._ _ _ _| _|_ ._ | _
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# | \| (_| | | | (/_ (_| |_ |_| |_) | (/_
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# |
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Path = namedtuple('Path', ['abs', 'rel'])
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EZ_config_path = namedtuple('EZ_config', ['path_in_module', 'path_in_ezfio'])
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EZ_handler = namedtuple('EZ_handler', ['ez_module', 'ez_cfg', 'ez_interface',
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'ez_config'])
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Sym_link = namedtuple('Sym_link', ['source', 'destination'])
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# _
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# |_ ._ _. ._ o _. |_ | _ _
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# |_ | | \/ \/ (_| | | (_| |_) | (/_ _>
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def ninja_create_env_variable(pwd_config_file):
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"""
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Return some ninja varible with the env variable expanded
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FC, FCFLAGS, IRPF90, IRPF90_FLAGS
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The env variable is usefull for the generation of EZFIO, and IRPF90
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"""
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l_string = []
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for flag in ["FC", "FCFLAGS", "IRPF90", "IRPF90_FLAGS"]:
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str_ = "{0} = {1}".format(flag, get_compilation_option(pwd_config_file,
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flag))
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l_string.append(str_)
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lib_lapack = get_compilation_option(pwd_config_file, "LAPACK_LIB")
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lib_ezfio = join(QPACKAGE_ROOT_EZFIO, "lib", "libezfio_irp.a")
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l_string.append("{0} = {1} {2}".format("LIB", lib_lapack, lib_ezfio))
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l_string.append("")
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return l_string
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# __
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# /__ _ ._ _ _. | _ _
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# \_| (/_ | | (/_ (_| | (_) (_| \/
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# _| /
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def dict_module_genelogy_path(d_module_genelogy):
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"""
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Just a dict with relative, and absolue path for the
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d_module_genelogy
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"""
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d = dict()
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for module_rel, l_children_rel in d_module_genelogy.iteritems():
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module_abs = join(QPACKAGE_ROOT_SRC, module_rel)
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p = Path(module_abs, module_rel)
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try:
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d[p] = Path(join(QPACKAGE_ROOT_SRC, l_children_rel),
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l_children_rel)
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except:
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d[p] = [Path(join(QPACKAGE_ROOT_SRC, children), children)
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for children in l_children_rel]
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return d
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# _ __ _ ___ _ _
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# |_ / |_ | / \ _ _|_ _
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# |_ /_ | _|_ \_/ o (_ | (_|
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# _|
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def get_l_module_with_ezfio_cfg():
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"""
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Return all the module who have a EZFIO.cfg
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"""
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from os import listdir
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from os.path import isfile, join
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qp_src = QPACKAGE_ROOT_SRC
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return [join(qp_src, m) for m in listdir(qp_src)
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if isfile(join(qp_src, m, "EZFIO.cfg"))]
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def get_l_ezfio_config():
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"""
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Return a namedtuple('EZ_config', ['path_in_module', 'path_in_ezfio'])
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"""
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l = []
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cmd = "{0}/*/*.ezfio_config".format(QPACKAGE_ROOT_SRC)
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for path_in_module in glob.glob(cmd):
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name_lower = os.path.split(path_in_module)[1].lower()
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path_in_ezfio = join(QPACKAGE_ROOT_EZFIO, "config", name_lower)
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l.append(EZ_config_path(path_in_module, path_in_ezfio))
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return l
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def ninja_ezfio_cfg_rule():
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"""
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Return the ezfio_interface rule who will create
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the _ezfio_interface.irp.f the _ezfio_config from the EZFIO.cfg
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"""
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l_string = ["rule build_ezfio_interface",
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" command = ei_handler.py --path_module $sub_module", ""]
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return l_string
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def ninja_ezfio_config_rule():
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"""
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If a ezfio_config existe you just need to move it
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"""
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l_string = ["rule build_ezfio_config", " command = cp $in $out", ""]
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return l_string
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def get_children_of_ezfio_cfg(l_module_with_ezfio_cfg):
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"""
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From a module list of ezfio_cfg return all the stuff create by him
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"""
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config_folder = join(QPACKAGE_ROOT_EZFIO, "config")
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l_util = dict()
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for m in l_module_with_ezfio_cfg:
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name_module = os.path.split(m)[1]
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name_module_lower = name_module.lower()
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rel = name_module
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abs_ = m
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ez_module = Path(abs_, rel)
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rel = "EZFIO.cfg"
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abs_ = join(m, "EZFIO.cfg")
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ez_cfg = Path(abs_, rel)
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rel = "ezfio_interface.irp.f"
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abs_ = join(m, rel)
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ez_interface = Path(abs_, rel)
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rel = "{0}.ezfio_interface_config".format(name_module_lower)
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abs_ = join(config_folder, rel)
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ez_config = Path(abs_, rel)
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l_util[ez_module.rel] = EZ_handler(ez_module, ez_cfg, ez_interface,
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ez_config)
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return l_util
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def ninja_ezfio_cfg_build(l_util):
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"""
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Return the children created by EZFIO.cfg
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For us is only ez_interface.irp.f and ez_config
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"""
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l_string = []
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for m in l_util.itervalues():
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str_ = "build {1} {2}: build_ezfio_interface {0}"
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l_string += [str_.format(m.ez_cfg.abs, m.ez_interface.abs,
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m.ez_config.abs)]
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l_string += [" sub_module = {0}".format(m.ez_module.abs)]
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l_string += [""]
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return l_string
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def ninja_ezfio_config_build(l_ezfio_config):
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"""
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For the ezfio_config present in module move then
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"""
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l_string = []
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for m in l_ezfio_config:
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file_source = m.path_in_module
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file_create = m.path_in_ezfio
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l_string += ["build {0}: build_ezfio_config {1}".format(file_create,
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file_source)]
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l_string += [""]
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return l_string
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def ninja_ezfio_rule():
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"""
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Retun the rule for creation the ezfio
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Set some variable
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and run ninja
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"""
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l_flag = ["export {0}='${0}'".format(flag)
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for flag in ["FC", "FCFLAGS", "IRPF90"]]
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l_cmd = ["cd {0}".format(QPACKAGE_ROOT_EZFIO)
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] + l_flag + ["ninja"]
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l_string = ["rule build_ezfio",
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" command = {0}".format(" ; ".join(l_cmd)),
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" description = Create $out"
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""]
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return l_string
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def ninja_ezfio_build(l_ezfio_config, l_util):
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"""
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Rule for create the ezfio
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we depend of the ezfio_config set by the user or created bu EZFIO.cfg
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"""
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l_ezfio_config = [i.path_in_ezfio for i in l_ezfio_config]
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l_ezfio_from_cfg = [i.ez_config.abs for i in l_util.itervalues()]
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str_ = " ".join(l_ezfio_config + l_ezfio_from_cfg)
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ezfio_make_config = join(QPACKAGE_ROOT_EZFIO,"make.config")
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l_string = ["build {0} {1}: build_ezfio {2}".format(EZFIO_LIB,
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ezfio_make_config,
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str_), ""]
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return l_string
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# __
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# (_ ._ _ | o ._ |
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# __) \/ | | | | | | | |<
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# /
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def get_source_destination(path_module, l_needed_molule):
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"""
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Return a list of Sym_link = namedtuple('Sym_link', ['source', 'destination'])
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for a module
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"""
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return [Sym_link(m.abs, join(QPACKAGE_ROOT_SRC, path_module.rel, m.rel))
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for m in l_needed_molule]
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def ninja_symlink_rule():
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"""
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Return the command to create for the symlink
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"""
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return ["rule build_symlink", " command = ln -sf $in $out", ""]
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def ninja_symlink_build(path_module, l_symlink):
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"""
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Create the symlink
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and the l_symlink who are all the symlink list
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"""
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if not l_symlink:
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return []
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l_string = ["build l_symlink_{0} : phony {1}".format(
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path_module.rel, " ".join([s.destination for s in l_symlink])), ""]
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for symlink in l_symlink:
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l_string += ["build {0}: build_symlink {1}".format(symlink.destination,
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symlink.source), ""]
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return l_string
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# _ _ _
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# o ._ ._ _|_ (_| / \ ._ _ _. | _
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# | | |_) | | \_/ o | | | (_| |< (/_
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# |
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def get_l_file_for_module(path_module):
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'''
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return the list of irp.f in a module
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'''
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l_irp = []
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l_src = []
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l_obj = []
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l_template = []
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for f in os.listdir(path_module.abs):
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if f.lower().endswith(tuple([".template.f", ".include.f"])):
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l_template.append(join(path_module.abs, f))
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elif f.endswith(".irp.f"):
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l_irp.append(join(path_module.abs, f))
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elif f.lower().endswith(tuple([".f", ".f90", ".c", ".cpp", ".cxx"])):
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l_src.append(f)
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obj = '{0}.o'.format(os.path.splitext(f)[0])
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l_obj.append(obj)
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elif f == "EZFIO.cfg":
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l_irp.append(join(path_module.abs, "ezfio_interface.irp.f"))
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d = {"l_irp": l_irp,
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"l_src": l_src,
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"l_obj": l_obj,
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"l_template": l_template}
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return d
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def get_file_dependency(d_info_module):
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"""
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For a module return all the irp.f90 file who depend
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"""
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d_irp = defaultdict(dict)
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for module, l_children in d_info_module.iteritems():
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for key, values in get_l_file_for_module(module).iteritems():
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if key in ["l_src"]:
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values = [join(module.abs,o) for o in values]
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if key in ["l_obj"]:
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values = [join(module.abs,"IRPF90_temp",o) for o in values]
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d_irp[module][key] = values
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for children in l_children:
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for key, values in get_l_file_for_module(children).iteritems():
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if key in ["l_src"]:
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values = [join(module.abs,children.rel,o) for o in values]
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if key in ["l_obj"]:
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values = [join(module.abs,"IRPF90_temp",children.rel,o) for o in values]
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d_irp[module][key].extend(values)
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return d_irp
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def ninja_irpf90_make_rule():
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"""
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The rule for creating the irpf90.make
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Export the flag and compile
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Only secontial make a possible
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"""
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# ~#~#~#~#~ #
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# F l a g s #
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# ~#~#~#~#~ #
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l_flag = []
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for flag in ["FC", "FCFLAGS", "LIB", "SRC", "OBJ"]:
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str_ = "export {0}='${0}'".format(flag)
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l_flag.append(str_)
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# ~#~#~ #
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# c m d #
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# ~#~#~ #
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l_cmd = ["cd $module"] + l_flag + ["irpf90 $include_dir $IRPF90_FLAGS"]
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# ~#~#~#~#~#~ #
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# s t r i n g #
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# ~#~#~#~#~#~ #
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l_string = ["pool irp_pool", " depth = 1", "", "rule build_irpf90.ninja",
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" command = {0}".format(" ; ".join(l_cmd)),
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" pool = irp_pool",
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" description = Create the IRP_Tree for $module", ""]
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return l_string
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def ninja_irpf90_make_build(path_module, l_needed_molule, d_irp):
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"""
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Creatre the dependency for a irpf90.make
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We need all the symklink and all the irp.f
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"""
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# ~#~#~#~#~#~ #
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# O u t p u t #
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# ~#~#~#~#~#~ #
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l_creation = [join(path_module.abs, i)
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for i in ["irpf90.make", "irpf90_entities", "tags",
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"IRPF90_temp/build.ninja"]]
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str_creation = " ".join(l_creation)
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# ~#~#~#~#~#~#~#~#~#~ #
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# D e p e n d a n c y #
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# ~#~#~#~#~#~#~#~#~#~ #
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l_irp_need = d_irp[path_module]["l_irp"]
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l_src = d_irp[path_module]["l_src"]
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l_obj = d_irp[path_module]["l_obj"]
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l_template = d_irp[path_module]["l_template"]
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if l_needed_molule:
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l_destination = ["l_symlink_{0}".format(path_module.rel)]
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else:
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l_destination = []
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str_depend = " ".join(l_irp_need + l_destination + l_src + l_template)
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# ~#~#~#~#~#~#~#~#~#~#~ #
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# N i n j a _ b u i l d #
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# ~#~#~#~#~#~#~#~#~#~#~ #
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l_include_dir = ["-I {0}".format(m.rel) for m in l_needed_molule]
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l_string = [
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"build {0}: build_irpf90.ninja {1}".format(str_creation, str_depend),
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" module = {0}".format(path_module.abs),
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" SRC = {0}".format(" ".join(l_src)),
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" OBJ = {0}".format(" ".join(l_obj)),
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" include_dir = {0}".format(" ".join(l_include_dir)), ""
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]
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return l_string
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def ninja_readme_rule():
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"""
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Rule for creation the readme.
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For not dealted the readme when ninja -t clean and the generator option
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"""
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l_string = ["rule build_readme",
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" command = cd $module ; update_README.py",
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" generator = 1", ""]
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return l_string
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def ninja_readme_build(path_module):
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"""
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Rule for creation the readme
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"""
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path_irp_man = join(path_module.abs, "irpf90.make")
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path_readme = join(path_module.abs, "README.rst")
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l_string = ["build {0}: build_readme {1}".format(path_readme,
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path_irp_man),
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" module = {0}".format(path_module.abs), ""]
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return l_string
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# _
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# |_) o ._ _. ._
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# |_) | | | (_| | \/
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# /
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def get_binaries(path_module):
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"""
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Return the list of binaries (Path= namedtuple('Path', ['abs', 'rel']) for a module
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"""
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import subprocess
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try:
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cmd = 'grep -l "program" {0}/*.irp.f'.format(path_module.abs)
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process = subprocess.Popen([cmd],
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shell=True,
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stdout=subprocess.PIPE,
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stderr=subprocess.PIPE)
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stdout, stderr = process.communicate()
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except OSError:
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return []
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else:
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if not stdout:
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return []
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elif "No such file or directory" not in stdout:
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l_bin = [i.replace(".irp.f", "", 1) for i in stdout.split()]
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return [Path(bin_, os.path.basename(bin_)) for bin_ in l_bin]
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else:
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return []
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def get_dict_binaries(l_module, mode="production"):
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"""
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Return a dict [module] = list_binaries
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If a the production mode is enable only header module
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who will produce all binaries
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Example : The module Full_CI can produce the binary SCF
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so you dont need to compile at all the module Hartree-Fock
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"""
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d_binaries = defaultdict(list)
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# Create d_binaries
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# Ake module => binaries generated
|
|
for module in l_module:
|
|
l_binaries = get_binaries(module)
|
|
|
|
if l_binaries:
|
|
d_binaries[module] += l_binaries
|
|
|
|
if mode == "production":
|
|
|
|
dict_root = ModuleHandler.dict_root
|
|
dict_root_path = dict_module_genelogy_path(dict_root)
|
|
|
|
d_binaries_condensed = defaultdict(list)
|
|
for module in d_binaries:
|
|
d_binaries_condensed[dict_root_path[module]] += d_binaries[module]
|
|
|
|
d_binaries = d_binaries_condensed
|
|
|
|
return d_binaries
|
|
|
|
|
|
def ninja_binaries_rule():
|
|
"""
|
|
Rule for creating the binaries
|
|
"""
|
|
|
|
# ~#~#~ #
|
|
# c m d #
|
|
# ~#~#~ #
|
|
|
|
l_cmd = ["cd $module/IRPF90_temp", "ninja"]
|
|
|
|
# ~#~#~#~#~#~ #
|
|
# s t r i n g #
|
|
# ~#~#~#~#~#~ #
|
|
|
|
l_string = ["rule build_binaries",
|
|
" command = {0}".format(" ; ".join(l_cmd)),
|
|
" description = Create all the binaries from $module", ""]
|
|
|
|
return l_string
|
|
|
|
|
|
def ninja_binaries_build(path_module, l_children, d_binaries):
|
|
"""
|
|
The binaries need the EZFIO_LIB, and the irpf90.make (aka build.ninja)
|
|
"""
|
|
|
|
# ~#~#~ #
|
|
# c m d #
|
|
# ~#~#~ #
|
|
|
|
ninja_module_path = join(path_module.abs, "IRPF90_temp", "build.ninja")
|
|
l_abs_bin = [binary.abs for binary in d_binaries[path_module]]
|
|
|
|
# ~#~#~#~#~#~ #
|
|
# s t r i n g #
|
|
# ~#~#~#~#~#~ #
|
|
|
|
l_string = ["build {0}: build_binaries {1} {2}".format(" ".join(l_abs_bin),
|
|
EZFIO_LIB,
|
|
ninja_module_path),
|
|
" module = {0}".format(path_module.abs), ""]
|
|
|
|
return l_string
|
|
|
|
|
|
# ___
|
|
# | ._ _ _ _| _ ._ _ ._ _| _ ._ _ o _ _
|
|
# | | (/_ (/_ (_| (/_ |_) (/_ | | (_| (/_ | | (_ | (/_ _>
|
|
# |
|
|
def ninja_dot_tree_rule():
|
|
"""
|
|
Rule for creating the binaries
|
|
"""
|
|
# ~#~#~ #
|
|
# c m d #
|
|
# ~#~#~ #
|
|
|
|
l_cmd = ["cd $module", "module_handler.py create_png"]
|
|
|
|
l_string = ["rule build_dot_tree",
|
|
" command = {0}".format(" ; ".join(l_cmd)),
|
|
" generator = 1",
|
|
" description = Generate Png representtion of the Tree Dependancies of $module",
|
|
""]
|
|
|
|
return l_string
|
|
|
|
|
|
def ninja_dot_tree_build(path_module):
|
|
|
|
path_tree = join(path_module.abs, "tree_dependency.png")
|
|
l_string = ["build {0}: build_dot_tree".format(path_tree),
|
|
" module = {0}".format(path_module.abs), ""]
|
|
|
|
return l_string
|
|
|
|
#
|
|
# |\/| _. o ._
|
|
# | | (_| | | |
|
|
#
|
|
if __name__ == "__main__":
|
|
|
|
arguments = docopt(__doc__)
|
|
pwd_config_file = arguments["CONFIG_FILE"]
|
|
|
|
# _
|
|
# |_ ._ _. ._ o _. |_ | _ _
|
|
# |_ | | \/ \/ (_| | | (_| |_) | (/_ _>
|
|
#
|
|
|
|
l_string = ninja_create_env_variable(pwd_config_file)
|
|
|
|
# _
|
|
# |_) | _
|
|
# | \ |_| | (/_
|
|
#
|
|
l_string += ninja_ezfio_cfg_rule()
|
|
|
|
l_string += ninja_symlink_rule()
|
|
|
|
l_string += ninja_irpf90_make_rule()
|
|
l_string += ninja_readme_rule()
|
|
|
|
l_string += ninja_binaries_rule()
|
|
|
|
l_string += ninja_ezfio_config_rule()
|
|
l_string += ninja_ezfio_rule()
|
|
|
|
l_string += ninja_dot_tree_rule()
|
|
|
|
# _
|
|
# |_) o | _| _ _ ._ _ ._ _. |
|
|
# |_) |_| | | (_| (_| (/_ | | (/_ | (_| |
|
|
# _|
|
|
l_module_with_ezfio_cfg = get_l_module_with_ezfio_cfg()
|
|
l_util = get_children_of_ezfio_cfg(l_module_with_ezfio_cfg)
|
|
l_ezfio_config = get_l_ezfio_config()
|
|
|
|
l_string += ninja_ezfio_cfg_build(l_util)
|
|
l_string += ninja_ezfio_config_build(l_ezfio_config)
|
|
l_string += ninja_ezfio_build(l_ezfio_config, l_util)
|
|
|
|
# _ _
|
|
# |_) o | _| _|_ _ ._ ._ _ _ _| | _
|
|
# |_) |_| | | (_| | (_) | | | | (_) (_| |_| | (/_
|
|
#
|
|
#
|
|
|
|
# ~#~#~#~#~#~#~#~#~#~#~#~#~#~ #
|
|
# G e n e a l o g y _ d i c t #
|
|
# ~#~#~#~#~#~#~#~#~#~#~#~#~#~ #
|
|
|
|
d_genealogy = ModuleHandler.dict_descendant
|
|
d_genealogy_path = dict_module_genelogy_path(d_genealogy)
|
|
d_irp = get_file_dependency(d_genealogy_path)
|
|
|
|
l_module = d_genealogy_path.keys()
|
|
|
|
d_binaries_production = get_dict_binaries(l_module,
|
|
mode="production")
|
|
|
|
# ~#~#~#~#~#~#~#~#~#~#~#~#~ #
|
|
# M o d u l e _ t o _ i r p #
|
|
# ~#~#~#~#~#~#~#~#~#~#~#~#~ #
|
|
|
|
if arguments["--production"]:
|
|
l_module_to_irp = d_binaries_production.keys()
|
|
|
|
elif arguments["--development"]:
|
|
l_module_to_irp = d_genealogy_path.keys()
|
|
|
|
for module_to_compile in l_module_to_irp:
|
|
|
|
# ~#~#~#~#~#~#~#~ #
|
|
# S y m l i n k #
|
|
# ~#~#~#~#~#~#~#~ #
|
|
l_children = d_genealogy_path[module_to_compile]
|
|
l_symlink = get_source_destination(module_to_compile, l_children)
|
|
|
|
l_string += ninja_symlink_build(module_to_compile, l_symlink)
|
|
|
|
# ~#~#~#~#~#~#~#~ #
|
|
# i r p . f 9 0 #
|
|
# ~#~#~#~#~#~#~#~ #
|
|
l_string += ninja_irpf90_make_build(module_to_compile, l_children,
|
|
d_irp)
|
|
|
|
# ~#~#~#~#~#~#~#~#~#~#~#~#~#~#~#~ #
|
|
# d o t _ t r e e & r e a d m e #
|
|
# ~#~#~#~#~#~#~#~#~#~#~#~#~#~#~#~ #
|
|
l_string += ninja_dot_tree_build(module_to_compile)
|
|
l_string += ninja_readme_build(module_to_compile)
|
|
|
|
# ~#~#~#~#~#~#~ #
|
|
# b i n a r y #
|
|
# ~#~#~#~#~#~#~ #
|
|
for module_to_compile in d_binaries_production.keys():
|
|
|
|
l_string += ninja_binaries_build(module_to_compile, l_children,
|
|
d_binaries_production)
|
|
|
|
with open(join(QPACKAGE_ROOT, "build.ninja"), "w+") as f:
|
|
f.write("\n".join(l_string))
|