mirror of
https://github.com/pfloos/quack
synced 2024-08-31 00:23:45 +02:00
265 lines
7.2 KiB
Python
Executable File
265 lines
7.2 KiB
Python
Executable File
#!/usr/bin/env python3
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import os
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import sys
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if "QUACK_ROOT" not in os.environ:
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os.chdir("..")
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print("")
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print("Please set the QUACK_ROOT environment variable, for example:")
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print("")
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print("$ export QUACK_ROOT={0}".format(os.getcwd()))
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print("")
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sys.exit(1)
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QUACK_ROOT=os.environ["QUACK_ROOT"]
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compile_gfortran_mac = """
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FC = gfortran
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AR = libtool
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FFLAGS = -I$IDIR -J$IDIR -Wall -Wno-unused -Wno-unused-dummy-argument -O3
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CC = gcc
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CXX = g++
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LAPACK=-lblas -llapack
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STDCXX=-lc++
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"""
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compile_gfortran_mac_debug = """
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FC = gfortran -I$IDIR -J$IDIR
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AR = libtool
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FFLAGS = -I$IDIR -J$IDIR -Wall -g -msse4.2 -fcheck=all -Waliasing -Wampersand -Wconversion -Wsurprising -Wintrinsics-std -Wno-tabs -Wintrinsic-shadow -Wline-truncation -Wreal-q-constant
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CC = gcc
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CXX = g++
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LAPACK=-lblas -llapack
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STDCXX=-lc++
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"""
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# TODO Change compiler here
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# --------------------------
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compiler = compile_gfortran_mac
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#compiler = compile_gfortran_mac_debug
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header = """#
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# This file was automatically generated. Do not modify this file.
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# To change compiling options, make the modifications in
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# {0}/src/make_ninja.py
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#
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QUACK_ROOT={0}
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IDIR=$QUACK_ROOT/include
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LDIR=$QUACK_ROOT/lib
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BDIR=$QUACK_ROOT/bin
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SDIR=$QUACK_ROOT/src
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LIBXC_VERSION=5.0.0
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""".format(QUACK_ROOT)
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rule_fortran = """
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rule fc
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command = $FC $FFLAGS -c $in -o $out && (mv -f *.mod $IDIR &> /dev/null || :)
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"""
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rule_build_lib = """
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rule build_lib
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command = $AR -static $in -o $out
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description = Linking $out
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"""
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LIBS="$LDIR/libxcf90.a $LDIR/libxc.a $LDIR/libnumgrid.a "
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rule_build_exe = """
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LIBS = {0} $LAPACK $STDCXX
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rule build_exe
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command = $FC $in $LIBS -o $out
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pool = console
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description = Linking $out
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rule build_lib
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command = cd $dir ; ninja $out
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pool = console
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description = Compiling $out
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""".format(LIBS)
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rule_git_clone = """
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rule git_clone
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command = cd $QUACK_ROOT ; git clone $url
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pool = console
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description = Cloning $in
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"""
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build_numgrid = """
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rule make_numgrid
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command = cd $QUACK_ROOT/utils ; LDIR="$LDIR" SDIR="$SDIR" CC="$CC" CXX="$CXX" FC="$FC" ./install_numgrid.sh
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description = Building numgrid
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pool = console
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build $LDIR/libnumgrid.a: make_numgrid
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generator = true
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"""
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build_libxc = """
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rule make_libxc
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command = cd $QUACK_ROOT/libxc-tools ; LIBXC_VERSION="$LIBXC_VERSION" QUACK_ROOT="$QUACK_ROOT" CC="$CC" CXX="$CXX" FC="$FC" ./install_libxc.sh
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description = Building libxc
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pool = console
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rule install_libxc
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command = cd $QUACK_ROOT/libxc-tools ; LIBXC_VERSION="$LIBXC_VERSION" QUACK_ROOT="$QUACK_ROOT" CC="$CC" CXX="$CXX" FC="$FC" ./install_libxc.sh install
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description = Installing libxc
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pool = console
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build $QUACK_ROOT/libxc-tools/libxc-$LIBXC_VERSION/src/.libs/libxcf90.a: make_libxc
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generator = true
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build $LDIR/libxc.a $LDIR/libxcf90.a $IDIR/xc.h $IDIR/xc_funcs_removed.h $IDIR/xc_f90_lib_m.mod $IDIR/xc_funcs_worker.h $IDIR/xc_funcs.h $IDIR/xc_version.h: install_libxc $QUACK_ROOT/libxc-tools/libxc-$LIBXC_VERSION/src/.libs/libxcf90.a
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generator = true
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"""
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build_qcaml = """
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rule install_qcaml
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command = cd $QUACK_ROOT/qcaml-tools ; ./install_qcaml.sh
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pool = console
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description = Installing QCaml
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build $QUACK_ROOT/qcaml-tools/qcaml/README.md: install_qcaml
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generator = true
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"""
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build_GoDuck = """
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rule make_goduck
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command = cd $QUACK_ROOT/qcaml-tools ; make
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pool = console
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description = Compiling GoDuck
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build $QUACK_ROOT/GoDuck: make_goduck $QUACK_ROOT/qcaml-tools/qcaml/README.md
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"""
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build_in_lib_dir = "\n".join([
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header,
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compiler,
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rule_fortran,
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rule_build_lib,
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])
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build_in_exe_dir = "\n".join([
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header,
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compiler,
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rule_fortran,
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rule_build_exe,
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build_libxc,
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])
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build_main = "\n".join([
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header,
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compiler,
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rule_git_clone,
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build_numgrid,
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build_libxc,
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build_qcaml,
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build_GoDuck,
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])
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exe_dirs = [ "QuAcK", "eDFT" ]
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lib_dirs = list(filter(lambda x: os.path.isdir(x) and \
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x not in exe_dirs, os.listdir(".")))
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def create_ninja_in_libdir(directory):
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def write_rule(f, source_file, replace):
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obj_file = os.path.join("obj", source_file.replace(replace, ".o"))
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f.write("build {0}: fc {1}\n".format(obj_file,source_file))
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return obj_file
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with open(os.path.join(directory, "build.ninja"),"w") as f:
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f.write(build_in_lib_dir)
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objects = []
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for filename in os.listdir(directory):
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for suffix in [".f", ".f90"]:
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if filename.endswith(suffix):
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obj_file = write_rule(f, filename, suffix)
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objects.append(obj_file)
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objects = " ".join(objects)
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f.write("build $LDIR/{0}.a: build_lib {1}\n".format(directory,objects))
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f.write("default $LDIR/{0}.a\n".format(directory))
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def create_ninja_in_exedir(directory):
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def write_rule(f, source_file, replace):
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obj_file = os.path.join("obj", source_file.replace(replace, ".o"))
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f.write("build {0}: fc {1}\n".format(obj_file,source_file))
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return obj_file
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with open(os.path.join(directory, "build.ninja"),"w") as f:
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f.write(build_in_exe_dir)
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objects = []
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for filename in os.listdir(directory):
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for suffix in [".f", ".f90"]:
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if filename.endswith(suffix):
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obj_file = write_rule(f, filename, suffix)
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objects.append(obj_file)
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objects = " ".join(objects)
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for libname in lib_dirs:
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f.write("build $LDIR/{0}.a: build_lib\n dir = $SDIR/{0}\n".format(libname))
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libs = " ".join([ "$LDIR/{0}.a".format(x) for x in lib_dirs]) + " "+LIBS
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f.write("build $BDIR/{0}: build_exe {1} {2}\n".format(directory,libs,objects))
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f.write("default $BDIR/{0}\n".format(directory))
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def create_main_ninja():
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libs = " ".join([ "$LDIR/{0}.a".format(x) for x in lib_dirs]) + " "+LIBS
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with open("build.ninja","w") as f:
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f.write(build_main)
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f.write("""
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rule build_exe
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command = cd $SDIR/$dir ; ninja $out
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pool = console
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rule build_lib
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command = cd $dir ; ninja $out
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pool = console
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description = Compiling $out
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""")
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for exe_dir in exe_dirs:
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sources = [ "$SDIR/{0}/{1}".format(exe_dir,x) for x in os.listdir(exe_dir) ]
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sources = filter(lambda x: x.endswith(".f") or x.endswith(".f90"), sources)
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sources = " ".join(sources)
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f.write("build $BDIR/{0}: build_exe {1} $LDIR/libnumgrid.a {2}\n".format(exe_dir,libs,sources))
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f.write(" dir = {0} \n".format(exe_dir) )
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for libname in lib_dirs:
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sources = [ "$SDIR/{0}/{1}".format(libname,x) for x in os.listdir(libname) ]
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sources = filter(lambda x: x.endswith(".f") or x.endswith(".f90"), sources)
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sources = " ".join(sources)
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f.write("build $LDIR/{0}.a: build_lib {1}\n dir = $SDIR/{0}\n".format(libname, sources))
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f.write("build all: phony $QUACK_ROOT/GoDuck $BDIR/QuAcK $BDIR/eDFT\n")
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f.write("default all\n")
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def create_makefile(directory):
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with open(os.path.join(directory, "Makefile"),"w") as f:
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f.write("""default:
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ninja
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make -C ..
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""")
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def main():
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for lib_dir in lib_dirs:
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create_ninja_in_libdir(lib_dir)
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create_makefile(lib_dir)
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for exe_dir in exe_dirs:
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create_ninja_in_exedir(exe_dir)
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create_makefile(lib_dir)
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create_main_ninja()
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if __name__ == '__main__':
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main()
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