mirror of
https://github.com/TREX-CoE/qmckl.git
synced 2024-12-22 04:14:49 +01:00
Automake working
This commit is contained in:
parent
0cb247e682
commit
18ef3a02b8
12
AUTHORS
Normal file
12
AUTHORS
Normal file
@ -0,0 +1,12 @@
|
||||
* Authors
|
||||
|
||||
- Anthony Scemama
|
||||
- Claudia Filippi
|
||||
- Francois Coppens
|
||||
- Pablo de Oliveira Castro
|
||||
- Ramón Panadés-Barrueta
|
||||
- Sandro Sorella
|
||||
- Vijay Gopal Chilkuri
|
||||
|
||||
|
||||
|
||||
368
INSTALL
Normal file
368
INSTALL
Normal file
@ -0,0 +1,368 @@
|
||||
Installation Instructions
|
||||
*************************
|
||||
|
||||
Copyright (C) 1994-1996, 1999-2002, 2004-2016 Free Software
|
||||
Foundation, Inc.
|
||||
|
||||
Copying and distribution of this file, with or without modification,
|
||||
are permitted in any medium without royalty provided the copyright
|
||||
notice and this notice are preserved. This file is offered as-is,
|
||||
without warranty of any kind.
|
||||
|
||||
Basic Installation
|
||||
==================
|
||||
|
||||
Briefly, the shell command './configure && make && make install'
|
||||
should configure, build, and install this package. The following
|
||||
more-detailed instructions are generic; see the 'README' file for
|
||||
instructions specific to this package. Some packages provide this
|
||||
'INSTALL' file but do not implement all of the features documented
|
||||
below. The lack of an optional feature in a given package is not
|
||||
necessarily a bug. More recommendations for GNU packages can be found
|
||||
in *note Makefile Conventions: (standards)Makefile Conventions.
|
||||
|
||||
The 'configure' shell script attempts to guess correct values for
|
||||
various system-dependent variables used during compilation. It uses
|
||||
those values to create a 'Makefile' in each directory of the package.
|
||||
It may also create one or more '.h' files containing system-dependent
|
||||
definitions. Finally, it creates a shell script 'config.status' that
|
||||
you can run in the future to recreate the current configuration, and a
|
||||
file 'config.log' containing compiler output (useful mainly for
|
||||
debugging 'configure').
|
||||
|
||||
It can also use an optional file (typically called 'config.cache' and
|
||||
enabled with '--cache-file=config.cache' or simply '-C') that saves the
|
||||
results of its tests to speed up reconfiguring. Caching is disabled by
|
||||
default to prevent problems with accidental use of stale cache files.
|
||||
|
||||
If you need to do unusual things to compile the package, please try
|
||||
to figure out how 'configure' could check whether to do them, and mail
|
||||
diffs or instructions to the address given in the 'README' so they can
|
||||
be considered for the next release. If you are using the cache, and at
|
||||
some point 'config.cache' contains results you don't want to keep, you
|
||||
may remove or edit it.
|
||||
|
||||
The file 'configure.ac' (or 'configure.in') is used to create
|
||||
'configure' by a program called 'autoconf'. You need 'configure.ac' if
|
||||
you want to change it or regenerate 'configure' using a newer version of
|
||||
'autoconf'.
|
||||
|
||||
The simplest way to compile this package is:
|
||||
|
||||
1. 'cd' to the directory containing the package's source code and type
|
||||
'./configure' to configure the package for your system.
|
||||
|
||||
Running 'configure' might take a while. While running, it prints
|
||||
some messages telling which features it is checking for.
|
||||
|
||||
2. Type 'make' to compile the package.
|
||||
|
||||
3. Optionally, type 'make check' to run any self-tests that come with
|
||||
the package, generally using the just-built uninstalled binaries.
|
||||
|
||||
4. Type 'make install' to install the programs and any data files and
|
||||
documentation. When installing into a prefix owned by root, it is
|
||||
recommended that the package be configured and built as a regular
|
||||
user, and only the 'make install' phase executed with root
|
||||
privileges.
|
||||
|
||||
5. Optionally, type 'make installcheck' to repeat any self-tests, but
|
||||
this time using the binaries in their final installed location.
|
||||
This target does not install anything. Running this target as a
|
||||
regular user, particularly if the prior 'make install' required
|
||||
root privileges, verifies that the installation completed
|
||||
correctly.
|
||||
|
||||
6. You can remove the program binaries and object files from the
|
||||
source code directory by typing 'make clean'. To also remove the
|
||||
files that 'configure' created (so you can compile the package for
|
||||
a different kind of computer), type 'make distclean'. There is
|
||||
also a 'make maintainer-clean' target, but that is intended mainly
|
||||
for the package's developers. If you use it, you may have to get
|
||||
all sorts of other programs in order to regenerate files that came
|
||||
with the distribution.
|
||||
|
||||
7. Often, you can also type 'make uninstall' to remove the installed
|
||||
files again. In practice, not all packages have tested that
|
||||
uninstallation works correctly, even though it is required by the
|
||||
GNU Coding Standards.
|
||||
|
||||
8. Some packages, particularly those that use Automake, provide 'make
|
||||
distcheck', which can by used by developers to test that all other
|
||||
targets like 'make install' and 'make uninstall' work correctly.
|
||||
This target is generally not run by end users.
|
||||
|
||||
Compilers and Options
|
||||
=====================
|
||||
|
||||
Some systems require unusual options for compilation or linking that
|
||||
the 'configure' script does not know about. Run './configure --help'
|
||||
for details on some of the pertinent environment variables.
|
||||
|
||||
You can give 'configure' initial values for configuration parameters
|
||||
by setting variables in the command line or in the environment. Here is
|
||||
an example:
|
||||
|
||||
./configure CC=c99 CFLAGS=-g LIBS=-lposix
|
||||
|
||||
*Note Defining Variables::, for more details.
|
||||
|
||||
Compiling For Multiple Architectures
|
||||
====================================
|
||||
|
||||
You can compile the package for more than one kind of computer at the
|
||||
same time, by placing the object files for each architecture in their
|
||||
own directory. To do this, you can use GNU 'make'. 'cd' to the
|
||||
directory where you want the object files and executables to go and run
|
||||
the 'configure' script. 'configure' automatically checks for the source
|
||||
code in the directory that 'configure' is in and in '..'. This is known
|
||||
as a "VPATH" build.
|
||||
|
||||
With a non-GNU 'make', it is safer to compile the package for one
|
||||
architecture at a time in the source code directory. After you have
|
||||
installed the package for one architecture, use 'make distclean' before
|
||||
reconfiguring for another architecture.
|
||||
|
||||
On MacOS X 10.5 and later systems, you can create libraries and
|
||||
executables that work on multiple system types--known as "fat" or
|
||||
"universal" binaries--by specifying multiple '-arch' options to the
|
||||
compiler but only a single '-arch' option to the preprocessor. Like
|
||||
this:
|
||||
|
||||
./configure CC="gcc -arch i386 -arch x86_64 -arch ppc -arch ppc64" \
|
||||
CXX="g++ -arch i386 -arch x86_64 -arch ppc -arch ppc64" \
|
||||
CPP="gcc -E" CXXCPP="g++ -E"
|
||||
|
||||
This is not guaranteed to produce working output in all cases, you
|
||||
may have to build one architecture at a time and combine the results
|
||||
using the 'lipo' tool if you have problems.
|
||||
|
||||
Installation Names
|
||||
==================
|
||||
|
||||
By default, 'make install' installs the package's commands under
|
||||
'/usr/local/bin', include files under '/usr/local/include', etc. You
|
||||
can specify an installation prefix other than '/usr/local' by giving
|
||||
'configure' the option '--prefix=PREFIX', where PREFIX must be an
|
||||
absolute file name.
|
||||
|
||||
You can specify separate installation prefixes for
|
||||
architecture-specific files and architecture-independent files. If you
|
||||
pass the option '--exec-prefix=PREFIX' to 'configure', the package uses
|
||||
PREFIX as the prefix for installing programs and libraries.
|
||||
Documentation and other data files still use the regular prefix.
|
||||
|
||||
In addition, if you use an unusual directory layout you can give
|
||||
options like '--bindir=DIR' to specify different values for particular
|
||||
kinds of files. Run 'configure --help' for a list of the directories
|
||||
you can set and what kinds of files go in them. In general, the default
|
||||
for these options is expressed in terms of '${prefix}', so that
|
||||
specifying just '--prefix' will affect all of the other directory
|
||||
specifications that were not explicitly provided.
|
||||
|
||||
The most portable way to affect installation locations is to pass the
|
||||
correct locations to 'configure'; however, many packages provide one or
|
||||
both of the following shortcuts of passing variable assignments to the
|
||||
'make install' command line to change installation locations without
|
||||
having to reconfigure or recompile.
|
||||
|
||||
The first method involves providing an override variable for each
|
||||
affected directory. For example, 'make install
|
||||
prefix=/alternate/directory' will choose an alternate location for all
|
||||
directory configuration variables that were expressed in terms of
|
||||
'${prefix}'. Any directories that were specified during 'configure',
|
||||
but not in terms of '${prefix}', must each be overridden at install time
|
||||
for the entire installation to be relocated. The approach of makefile
|
||||
variable overrides for each directory variable is required by the GNU
|
||||
Coding Standards, and ideally causes no recompilation. However, some
|
||||
platforms have known limitations with the semantics of shared libraries
|
||||
that end up requiring recompilation when using this method, particularly
|
||||
noticeable in packages that use GNU Libtool.
|
||||
|
||||
The second method involves providing the 'DESTDIR' variable. For
|
||||
example, 'make install DESTDIR=/alternate/directory' will prepend
|
||||
'/alternate/directory' before all installation names. The approach of
|
||||
'DESTDIR' overrides is not required by the GNU Coding Standards, and
|
||||
does not work on platforms that have drive letters. On the other hand,
|
||||
it does better at avoiding recompilation issues, and works well even
|
||||
when some directory options were not specified in terms of '${prefix}'
|
||||
at 'configure' time.
|
||||
|
||||
Optional Features
|
||||
=================
|
||||
|
||||
If the package supports it, you can cause programs to be installed
|
||||
with an extra prefix or suffix on their names by giving 'configure' the
|
||||
option '--program-prefix=PREFIX' or '--program-suffix=SUFFIX'.
|
||||
|
||||
Some packages pay attention to '--enable-FEATURE' options to
|
||||
'configure', where FEATURE indicates an optional part of the package.
|
||||
They may also pay attention to '--with-PACKAGE' options, where PACKAGE
|
||||
is something like 'gnu-as' or 'x' (for the X Window System). The
|
||||
'README' should mention any '--enable-' and '--with-' options that the
|
||||
package recognizes.
|
||||
|
||||
For packages that use the X Window System, 'configure' can usually
|
||||
find the X include and library files automatically, but if it doesn't,
|
||||
you can use the 'configure' options '--x-includes=DIR' and
|
||||
'--x-libraries=DIR' to specify their locations.
|
||||
|
||||
Some packages offer the ability to configure how verbose the
|
||||
execution of 'make' will be. For these packages, running './configure
|
||||
--enable-silent-rules' sets the default to minimal output, which can be
|
||||
overridden with 'make V=1'; while running './configure
|
||||
--disable-silent-rules' sets the default to verbose, which can be
|
||||
overridden with 'make V=0'.
|
||||
|
||||
Particular systems
|
||||
==================
|
||||
|
||||
On HP-UX, the default C compiler is not ANSI C compatible. If GNU CC
|
||||
is not installed, it is recommended to use the following options in
|
||||
order to use an ANSI C compiler:
|
||||
|
||||
./configure CC="cc -Ae -D_XOPEN_SOURCE=500"
|
||||
|
||||
and if that doesn't work, install pre-built binaries of GCC for HP-UX.
|
||||
|
||||
HP-UX 'make' updates targets which have the same time stamps as their
|
||||
prerequisites, which makes it generally unusable when shipped generated
|
||||
files such as 'configure' are involved. Use GNU 'make' instead.
|
||||
|
||||
On OSF/1 a.k.a. Tru64, some versions of the default C compiler cannot
|
||||
parse its '<wchar.h>' header file. The option '-nodtk' can be used as a
|
||||
workaround. If GNU CC is not installed, it is therefore recommended to
|
||||
try
|
||||
|
||||
./configure CC="cc"
|
||||
|
||||
and if that doesn't work, try
|
||||
|
||||
./configure CC="cc -nodtk"
|
||||
|
||||
On Solaris, don't put '/usr/ucb' early in your 'PATH'. This
|
||||
directory contains several dysfunctional programs; working variants of
|
||||
these programs are available in '/usr/bin'. So, if you need '/usr/ucb'
|
||||
in your 'PATH', put it _after_ '/usr/bin'.
|
||||
|
||||
On Haiku, software installed for all users goes in '/boot/common',
|
||||
not '/usr/local'. It is recommended to use the following options:
|
||||
|
||||
./configure --prefix=/boot/common
|
||||
|
||||
Specifying the System Type
|
||||
==========================
|
||||
|
||||
There may be some features 'configure' cannot figure out
|
||||
automatically, but needs to determine by the type of machine the package
|
||||
will run on. Usually, assuming the package is built to be run on the
|
||||
_same_ architectures, 'configure' can figure that out, but if it prints
|
||||
a message saying it cannot guess the machine type, give it the
|
||||
'--build=TYPE' option. TYPE can either be a short name for the system
|
||||
type, such as 'sun4', or a canonical name which has the form:
|
||||
|
||||
CPU-COMPANY-SYSTEM
|
||||
|
||||
where SYSTEM can have one of these forms:
|
||||
|
||||
OS
|
||||
KERNEL-OS
|
||||
|
||||
See the file 'config.sub' for the possible values of each field. If
|
||||
'config.sub' isn't included in this package, then this package doesn't
|
||||
need to know the machine type.
|
||||
|
||||
If you are _building_ compiler tools for cross-compiling, you should
|
||||
use the option '--target=TYPE' to select the type of system they will
|
||||
produce code for.
|
||||
|
||||
If you want to _use_ a cross compiler, that generates code for a
|
||||
platform different from the build platform, you should specify the
|
||||
"host" platform (i.e., that on which the generated programs will
|
||||
eventually be run) with '--host=TYPE'.
|
||||
|
||||
Sharing Defaults
|
||||
================
|
||||
|
||||
If you want to set default values for 'configure' scripts to share,
|
||||
you can create a site shell script called 'config.site' that gives
|
||||
default values for variables like 'CC', 'cache_file', and 'prefix'.
|
||||
'configure' looks for 'PREFIX/share/config.site' if it exists, then
|
||||
'PREFIX/etc/config.site' if it exists. Or, you can set the
|
||||
'CONFIG_SITE' environment variable to the location of the site script.
|
||||
A warning: not all 'configure' scripts look for a site script.
|
||||
|
||||
Defining Variables
|
||||
==================
|
||||
|
||||
Variables not defined in a site shell script can be set in the
|
||||
environment passed to 'configure'. However, some packages may run
|
||||
configure again during the build, and the customized values of these
|
||||
variables may be lost. In order to avoid this problem, you should set
|
||||
them in the 'configure' command line, using 'VAR=value'. For example:
|
||||
|
||||
./configure CC=/usr/local2/bin/gcc
|
||||
|
||||
causes the specified 'gcc' to be used as the C compiler (unless it is
|
||||
overridden in the site shell script).
|
||||
|
||||
Unfortunately, this technique does not work for 'CONFIG_SHELL' due to an
|
||||
Autoconf limitation. Until the limitation is lifted, you can use this
|
||||
workaround:
|
||||
|
||||
CONFIG_SHELL=/bin/bash ./configure CONFIG_SHELL=/bin/bash
|
||||
|
||||
'configure' Invocation
|
||||
======================
|
||||
|
||||
'configure' recognizes the following options to control how it
|
||||
operates.
|
||||
|
||||
'--help'
|
||||
'-h'
|
||||
Print a summary of all of the options to 'configure', and exit.
|
||||
|
||||
'--help=short'
|
||||
'--help=recursive'
|
||||
Print a summary of the options unique to this package's
|
||||
'configure', and exit. The 'short' variant lists options used only
|
||||
in the top level, while the 'recursive' variant lists options also
|
||||
present in any nested packages.
|
||||
|
||||
'--version'
|
||||
'-V'
|
||||
Print the version of Autoconf used to generate the 'configure'
|
||||
script, and exit.
|
||||
|
||||
'--cache-file=FILE'
|
||||
Enable the cache: use and save the results of the tests in FILE,
|
||||
traditionally 'config.cache'. FILE defaults to '/dev/null' to
|
||||
disable caching.
|
||||
|
||||
'--config-cache'
|
||||
'-C'
|
||||
Alias for '--cache-file=config.cache'.
|
||||
|
||||
'--quiet'
|
||||
'--silent'
|
||||
'-q'
|
||||
Do not print messages saying which checks are being made. To
|
||||
suppress all normal output, redirect it to '/dev/null' (any error
|
||||
messages will still be shown).
|
||||
|
||||
'--srcdir=DIR'
|
||||
Look for the package's source code in directory DIR. Usually
|
||||
'configure' can determine that directory automatically.
|
||||
|
||||
'--prefix=DIR'
|
||||
Use DIR as the installation prefix. *note Installation Names:: for
|
||||
more details, including other options available for fine-tuning the
|
||||
installation locations.
|
||||
|
||||
'--no-create'
|
||||
'-n'
|
||||
Run the configure checks, but stop before creating any output
|
||||
files.
|
||||
|
||||
'configure' also accepts some other, not widely useful, options. Run
|
||||
'configure --help' for more details.
|
||||
54
Makefile.am
Normal file
54
Makefile.am
Normal file
@ -0,0 +1,54 @@
|
||||
# QMCkl - Quantum Monte Carlo kernel library
|
||||
#
|
||||
# BSD 3-Clause License
|
||||
#
|
||||
# Copyright (c) 2020, TREX Center of Excellence
|
||||
# All rights reserved.
|
||||
#
|
||||
# Redistribution and use in source and binary forms, with or without
|
||||
# modification, are permitted provided that the following conditions are met:
|
||||
#
|
||||
# 1. Redistributions of source code must retain the above copyright notice, this
|
||||
# list of conditions and the following disclaimer.
|
||||
#
|
||||
# 2. Redistributions in binary form must reproduce the above copyright notice,
|
||||
# this list of conditions and the following disclaimer in the documentation
|
||||
# and/or other materials provided with the distribution.
|
||||
#
|
||||
# 3. Neither the name of the copyright holder nor the names of its
|
||||
# contributors may be used to endorse or promote products derived from
|
||||
# this software without specific prior written permission.
|
||||
#
|
||||
# THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS"
|
||||
# AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE
|
||||
# IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE ARE
|
||||
# DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT HOLDER OR CONTRIBUTORS BE LIABLE
|
||||
# FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL
|
||||
# DAMAGES (INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS OR
|
||||
# SERVICES; LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER
|
||||
# CAUSED AND ON ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY,
|
||||
# OR TORT (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE
|
||||
# OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
|
||||
|
||||
|
||||
ACLOCAL_AMFLAGS = -I m4
|
||||
|
||||
VERSION_MAJOR = @VERSION_MAJOR@
|
||||
VERSION_MINOR = @VERSION_MINOR@
|
||||
VERSION_PATCH = @VERSION_PATCH@
|
||||
|
||||
SUBDIRS = src
|
||||
|
||||
pkgconfigdir = $(libdir)/pkgconfig
|
||||
pkgconfig_DATA = qmckl.pc
|
||||
|
||||
rpms srcrpm:
|
||||
for dir in $(SUBDIRS); do \
|
||||
(cd $$dir && $(MAKE) $(AM_MAKEFLAGS) $@) || exit 1; \
|
||||
done
|
||||
|
||||
.PHONY: rpms srcrpm
|
||||
|
||||
README: README.md
|
||||
COPYING: LICENSE
|
||||
|
||||
991
Makefile.in
991
Makefile.in
File diff suppressed because it is too large
Load Diff
27
README.md
27
README.md
@ -21,6 +21,33 @@ to dowload also the [munit](https://github.com/nemequ/munit) unit testing
|
||||
framework.
|
||||
|
||||
|
||||
# Installation
|
||||
|
||||
The simplest way to obtain the source files of QMCkl is to download a source
|
||||
distribution. This particular repository is for maintainers, who write the kernels
|
||||
in org-mode files and produce the source code and the documentation from these files.
|
||||
|
||||
## For maintainers
|
||||
|
||||
```
|
||||
autoreconf
|
||||
./configure --enable-maintainer-mode --enable-debug
|
||||
make
|
||||
make check
|
||||
```
|
||||
|
||||
## For users
|
||||
|
||||
Obtain a source distribution and run
|
||||
|
||||
```
|
||||
./configure
|
||||
make
|
||||
make check
|
||||
sudo make install
|
||||
sudo make installcheck
|
||||
```
|
||||
|
||||
------------------------------
|
||||
|
||||
|
||||
|
||||
@ -1,6 +0,0 @@
|
||||
#!/bin/bash
|
||||
|
||||
autoreconf --install
|
||||
automake --add-missing --copy &> /dev/null
|
||||
exit 0
|
||||
|
||||
124
configure.ac
124
configure.ac
@ -1,14 +1,46 @@
|
||||
# -*- Autoconf -*-
|
||||
# Process this file with autoconf to produce a configure script.
|
||||
#
|
||||
# configure script for maintainers.
|
||||
# QMCkl - Quantum Monte Carlo kernel library
|
||||
#
|
||||
# BSD 3-Clause License
|
||||
#
|
||||
# Copyright (c) 2020, TREX Center of Excellence
|
||||
# All rights reserved.
|
||||
#
|
||||
# Redistribution and use in source and binary forms, with or without
|
||||
# modification, are permitted provided that the following conditions are met:
|
||||
#
|
||||
# 1. Redistributions of source code must retain the above copyright notice, this
|
||||
# list of conditions and the following disclaimer.
|
||||
#
|
||||
# 2. Redistributions in binary form must reproduce the above copyright notice,
|
||||
# this list of conditions and the following disclaimer in the documentation
|
||||
# and/or other materials provided with the distribution.
|
||||
#
|
||||
# 3. Neither the name of the copyright holder nor the names of its
|
||||
# contributors may be used to endorse or promote products derived from
|
||||
# this software without specific prior written permission.
|
||||
#
|
||||
# THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS"
|
||||
# AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE
|
||||
# IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE ARE
|
||||
# DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT HOLDER OR CONTRIBUTORS BE LIABLE
|
||||
# FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL
|
||||
# DAMAGES (INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS OR
|
||||
# SERVICES; LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER
|
||||
# CAUSED AND ON ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY,
|
||||
# OR TORT (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE
|
||||
# OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
|
||||
|
||||
AC_PREREQ([2.69])
|
||||
|
||||
AC_INIT([QMCkl],[0.1.1],
|
||||
[https://github.com/TREX-CoE/qmckl/issues], [],
|
||||
[https://trex-coe.github.io/qmckl/index.html])
|
||||
|
||||
AM_INIT_AUTOMAKE([color-tests parallel-tests silent-rules 1.11])
|
||||
AM_MAINTAINER_MODE()
|
||||
LT_INIT
|
||||
AC_CONFIG_SRCDIR([src/README.org])
|
||||
AC_CONFIG_HEADERS([include/config.h])
|
||||
AC_CONFIG_MACRO_DIR([m4])
|
||||
@ -20,12 +52,13 @@ VERSION_PATCH=`echo ${PACKAGE_VERSION} | cut -d. -f3 | cut -d- -f1`
|
||||
AC_DEFINE_UNQUOTED(QMCKL_VERSION_MAJOR, [$VERSION_MAJOR], [major version])
|
||||
AC_DEFINE_UNQUOTED(QMCKL_VERSION_MINOR, [$VERSION_MINOR], [minor version])
|
||||
AC_DEFINE_UNQUOTED(QMCKL_VERSION_PATCH, [$VERSION_PATCH], [patch version])
|
||||
AC_SUBST([VERSION_MAJOR])
|
||||
AC_SUBST([VERSION_MINOR])
|
||||
AC_SUBST([VERSION_PATCH])
|
||||
|
||||
#AM_INIT_AUTOMAKE([foreign color-tests parallel-tests silent-rules 1.11])
|
||||
#AM_SILENT_RULES(yes)
|
||||
#AC_SUBST(SHARED_VERSION_INFO)
|
||||
#AM_ENABLE_SHARED(no) dnl shared libs cause too many headaches to be default
|
||||
#AC_PROG_LIBTOOL
|
||||
|
||||
AC_LANG(C)
|
||||
|
||||
@ -36,51 +69,16 @@ AC_PROG_FC
|
||||
AC_PROG_FC_C_O
|
||||
AC_FC_SRCEXT([f90])
|
||||
AC_FC_FREEFORM
|
||||
AC_PROG_LIBTOOL
|
||||
AC_PROG_INSTALL
|
||||
AC_PROG_LN_S
|
||||
AC_PROG_CC_C99
|
||||
AC_CHECK_PROGS([EMACS],[emacs26 emacs],[no])
|
||||
AC_CHECK_PROGS([HAS_CPPCHECK],[cppcheck],[no])
|
||||
PKG_PROG_PKG_CONFIG()
|
||||
PKG_PROG_PKG_CONFIG([])
|
||||
PKG_LIBS=""
|
||||
PKG_CFLAGS=""
|
||||
|
||||
if test x${EMACS} == xno ; then
|
||||
AC_MSG_ERROR([
|
||||
--------------------------------------
|
||||
Error: Emacs is required for org-mode.
|
||||
--------------------------------------
|
||||
])
|
||||
fi
|
||||
|
||||
if test x${HAS_CPPCHECK} == xno ; then
|
||||
HAS_CPPCHECK=0
|
||||
else
|
||||
HAS_CPPCHECK=1
|
||||
fi
|
||||
AC_SUBST([HAS_CPPCHECK])
|
||||
|
||||
# fPIC option
|
||||
AC_MSG_CHECKING(whether fPIC compiler option is accepted in C)
|
||||
SAVED_CFLAGS="${CFLAGS}"
|
||||
CFLAGS="${CFLAGS} -fPIC -Werror"
|
||||
AC_COMPILE_IFELSE([AC_LANG_PROGRAM([], [return 0;])],
|
||||
[AC_MSG_RESULT(yes)
|
||||
CFLAGS="${SAVED_CFLAGS} -fPIC"],
|
||||
[AC_MSG_RESULT(no)
|
||||
CFLAGS="${SAVED_CFLAGS}"])
|
||||
|
||||
AC_MSG_CHECKING(whether fPIC compiler option is accepted in Fortran)
|
||||
SAVED_FCFLAGS="${FCFLAGS}"
|
||||
FCFLAGS="${FCFLAGS} -fPIC -Werror"
|
||||
AC_LANG_PUSH(Fortran)
|
||||
AC_COMPILE_IFELSE([AC_LANG_PROGRAM([], [])],
|
||||
[AC_MSG_RESULT(yes)
|
||||
FCFLAGS="${SAVED_FCFLAGS} -fPIC"],
|
||||
[AC_MSG_RESULT(no)
|
||||
FCFLAGS="${SAVED_FCFLAGS}"])
|
||||
AC_LANG_POP()
|
||||
|
||||
# Checks for libraries.
|
||||
|
||||
AC_FC_LIBRARY_LDFLAGS
|
||||
@ -200,7 +198,35 @@ AC_FUNC_STRERROR_R
|
||||
AC_FUNC_FORK
|
||||
AC_CHECK_FUNCS([clock_gettime dup2 gettimeofday nl_langinfo setlocale strcasecmp strtoul])
|
||||
|
||||
if test "x${MAINT}" = "x${MAINTAINER_MODE_TRUE}"; then
|
||||
|
||||
AC_PROG_AWK
|
||||
cd src && ../tools/create_makefile.sh && cd ..
|
||||
|
||||
AC_CHECK_PROGS([EMACS],[emacs26 emacs],[no])
|
||||
if test x${EMACS} == xno ; then
|
||||
AC_MSG_ERROR([
|
||||
--------------------------------------
|
||||
Error: Emacs is required for org-mode.
|
||||
--------------------------------------
|
||||
])
|
||||
fi
|
||||
|
||||
AC_CHECK_PROGS([HAS_CPPCHECK],[cppcheck],[no])
|
||||
if test x${HAS_CPPCHECK} != xno ; then
|
||||
HAS_CPPCHECK=1
|
||||
fi
|
||||
fi
|
||||
|
||||
AC_SUBST([ORG_FILES])
|
||||
AC_SUBST([C_FILES])
|
||||
AC_SUBST([F_FILES])
|
||||
AC_SUBST([FH_FUNC_FILES])
|
||||
AC_SUBST([FH_TYPE_FILES])
|
||||
AC_SUBST([H_FUNC_FILES])
|
||||
AC_SUBST([H_TYPE_FILES])
|
||||
AC_SUBST([H_PRIVATE_FUNC_FILES])
|
||||
AC_SUBST([H_PRIVATE_TYPE_FILES])
|
||||
|
||||
#PKG-CONFIG
|
||||
#mkl-dynamic-lp64-seq
|
||||
@ -212,8 +238,6 @@ AC_SUBST([PKG_CFLAGS])
|
||||
|
||||
AC_CONFIG_FILES([Makefile
|
||||
qmckl.pc
|
||||
configure.ac.dist
|
||||
src/Makefile.generated
|
||||
src/Makefile])
|
||||
|
||||
|
||||
@ -226,13 +250,13 @@ ${PACKAGE_NAME} Version ${PACKAGE_VERSION}
|
||||
|
||||
Prefix: '${prefix}'.
|
||||
|
||||
CC: ${CC}
|
||||
CPPFLAGS: ${CPPFLAGS}
|
||||
CFLAGS: ${CFLAGS}
|
||||
FC: ${FC}
|
||||
FCLAGS: ${FCFLAGS}
|
||||
LDFLAGS: ${LDFLAGS}
|
||||
LIBS: ${LIBS}
|
||||
CC..........: ${CC}
|
||||
CPPFLAGS....: ${CPPFLAGS}
|
||||
CFLAGS......: ${CFLAGS}
|
||||
FC..........: ${FC}
|
||||
FCLAGS......: ${FCFLAGS}
|
||||
LDFLAGS:....: ${LDFLAGS}
|
||||
LIBS........: ${LIBS}
|
||||
|
||||
Package features:
|
||||
${ARGS}
|
||||
|
||||
@ -19,6 +19,9 @@
|
||||
don't. */
|
||||
#undef HAVE_DECL_STRERROR_R
|
||||
|
||||
/* Define to 1 if you have the <dlfcn.h> header file. */
|
||||
#undef HAVE_DLFCN_H
|
||||
|
||||
/* Define to 1 if you have the `dup2' function. */
|
||||
#undef HAVE_DUP2
|
||||
|
||||
@ -147,12 +150,18 @@
|
||||
/* Define to 1 if the system has the type `_Bool'. */
|
||||
#undef HAVE__BOOL
|
||||
|
||||
/* Define to the sub-directory where libtool stores uninstalled libraries. */
|
||||
#undef LT_OBJDIR
|
||||
|
||||
/* Define to use debugging malloc/free */
|
||||
#undef MALLOC_TRACE
|
||||
|
||||
/* Define to 1 if your C compiler doesn't accept -c and -o together. */
|
||||
#undef NO_MINUS_C_MINUS_O
|
||||
|
||||
/* Name of package */
|
||||
#undef PACKAGE
|
||||
|
||||
/* Define to the address where bug reports for this package should be sent. */
|
||||
#undef PACKAGE_BUGREPORT
|
||||
|
||||
@ -186,6 +195,9 @@
|
||||
/* Define to 1 if strerror_r returns char *. */
|
||||
#undef STRERROR_R_CHAR_P
|
||||
|
||||
/* Version number of package */
|
||||
#undef VERSION
|
||||
|
||||
/* Define for Solaris 2.5.1 so the uint32_t typedef from <sys/synch.h>,
|
||||
<pthread.h>, or <semaphore.h> is not used. If the typedef were allowed, the
|
||||
#define below would cause a syntax error. */
|
||||
|
||||
56
src/Makefile.am
Normal file
56
src/Makefile.am
Normal file
@ -0,0 +1,56 @@
|
||||
LC_MESSAGES=C
|
||||
export LC_MESSAGES
|
||||
|
||||
SUBDIRS =
|
||||
|
||||
libqmckl_la_version = $(VERSION_MAJOR).$(VERSION_MINOR)
|
||||
|
||||
#lib_LTLIBRARIES = libqmckl-$(libqmckl_so_version).la
|
||||
lib_LTLIBRARIES = libqmckl.la
|
||||
|
||||
include generated.mk
|
||||
qmckl_h = $(top_srcdir)/include/qmckl.h
|
||||
qmckl_f = $(top_srcdir)/share/qmckl/fortran/qmckl_f.f90
|
||||
|
||||
BUILT_SOURCES= $(C_FILES) $(F_FILES) $(FH_FUNC_FILES) $(FH_TYPE_FILES) $(H_FUNC_FILES) $(H_TYPE_FILES) $(H_PRIVATE_FUNC_FILES) $(H_PRIVATE_TYPE_FILES)
|
||||
|
||||
libqmckl_la_CPPFLAGS = -I$(srcdir) -I$(top_srcdir)/include
|
||||
libqmckl_la_SOURCES = $(C_FILES) $(F_FILES) $(qmckl_h) $(qmckl_f) $(H_PRIVATE_FUNC_FILES) $(H_PRIVATE_TYPE_FILES)
|
||||
|
||||
tangle_verbose = $(tangle_verbose_@AM_V@)
|
||||
tangle_verbose_ = $(tangle_verbose_@AM_DEFAULT_V@)
|
||||
tangle_verbose_0 = @echo " TANGLE $@";
|
||||
|
||||
cat_h_verbose = $(cat_h_verbose_@AM_V@)
|
||||
cat_h_verbose_ = $(cat_h_verbose_@AM_DEFAULT_V@)
|
||||
cat_h_verbose_0 = @echo " HEADER $@";
|
||||
|
||||
|
||||
|
||||
export top_srcdir
|
||||
|
||||
Makefile.in: generated.mk
|
||||
|
||||
generated.mk: $(ORG_FILES)
|
||||
$(top_srcdir)/tools/create_makefile.sh
|
||||
|
||||
qmckl.h qmckl_f.f90: $(FH_FUNC_FILES) $(H_FUNC_FILES) $(H_TYPE_FILES)
|
||||
$(cat_h_verbose)$(top_srcdir)/tools/build_qmckl_h.sh
|
||||
|
||||
SUFFIXES = .f90 .h .org .c
|
||||
|
||||
.f90: $(ORG_FILES)
|
||||
$(tangle_verbose)$(top_srcdir)/tools/tangle.sh $(ORG_FILES)
|
||||
|
||||
.h: $(ORG_FILES)
|
||||
$(tangle_verbose)$(top_srcdir)/tools/tangle.sh $(ORG_FILES)
|
||||
|
||||
.org.c:
|
||||
$(tangle_verbose)$(top_srcdir)/tools/tangle.sh $<
|
||||
|
||||
$(qmckl_f): qmckl_f.f90
|
||||
mv qmckl_f.f90 $(qmckl_f)
|
||||
|
||||
$(qmckl_h): qmckl.h
|
||||
mv qmckl.h $(qmckl_h)
|
||||
|
||||
@ -1,112 +0,0 @@
|
||||
.POSIX:
|
||||
.SUFFIXES:
|
||||
|
||||
package = @PACKAGE_TARNAME@
|
||||
version = @PACKAGE_VERSION@
|
||||
|
||||
# VPATH-related substitution variables
|
||||
srcdir = @srcdir@
|
||||
VPATH = @srcdir@
|
||||
|
||||
prefix = @prefix@
|
||||
|
||||
CC = @CC@
|
||||
DEFS = @DEFS@
|
||||
CFLAGS = @CFLAGS@ -I$(top_srcdir)/munit/ -I$(top_srcdir)/include -I.
|
||||
CPPFLAGS = @CPPFLAGS@
|
||||
LIBS = @LIBS@
|
||||
|
||||
FC = @FC@
|
||||
FCFLAGS= @FCFLAGS@
|
||||
|
||||
OBJECT_FILES=qmckl_f.o qmckl_ao.o qmckl_ao_f.o qmckl_context.o qmckl_distance_f.o qmckl_electron.o qmckl_electron_f.o qmckl_error.o qmckl_memory.o qmckl_numprec.o
|
||||
|
||||
TESTS = test_qmckl_ao.o test_qmckl_context.o test_qmckl_distance.o test_qmckl_electron.o test_qmckl_error.o test_qmckl_memory.o test_qmckl_numprec.o
|
||||
TESTS_F = test_qmckl_ao_f.o test_qmckl_distance_f.o
|
||||
|
||||
LIBS = @LIBS@
|
||||
FCLIBS = @FCLIBS@
|
||||
|
||||
top_srcdir=$(srcdir)/..
|
||||
shared_lib=$(top_srcdir)/lib/libqmckl.so
|
||||
static_lib=$(top_srcdir)/lib/libqmckl.a
|
||||
qmckl_h=$(top_srcdir)/include/qmckl.h
|
||||
qmckl_f=$(top_srcdir)/share/qmckl/fortran/qmckl_f.f90
|
||||
munit=$(top_srcdir)/munit/munit.c
|
||||
|
||||
datarootdir=$(prefix)/share
|
||||
datadir=$(datarootdir)
|
||||
docdir=$(datarootdir)/doc/$(package)
|
||||
htmldir=$(docdir)/html
|
||||
libdir=$(prefix)/lib
|
||||
includedir=$(prefix)/include
|
||||
fortrandir=$(datarootdir)/$(package)/fortran
|
||||
|
||||
|
||||
shared: $(shared_lib)
|
||||
static: $(static_lib)
|
||||
|
||||
|
||||
all: shared static
|
||||
|
||||
$(shared_lib): $(OBJECT_FILES)
|
||||
$(CC) -shared $(OBJECT_FILES) -o $(shared_lib)
|
||||
|
||||
$(static_lib): $(OBJECT_FILES)
|
||||
$(AR) rcs $(static_lib) $(OBJECT_FILES)
|
||||
|
||||
|
||||
# Test
|
||||
|
||||
qmckl_f.o: $(qmckl_f)
|
||||
$(FC) $(FCFLAGS) -c $(qmckl_f) -o $@
|
||||
|
||||
test_qmckl: test_qmckl.c $(qmckl_h) $(static_lib) $(TESTS) $(TESTS_F)
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) $(munit) $(TESTS) $(TESTS_F) \
|
||||
$(static_lib) $(LIBS) $(FCLIBS) test_qmckl.c -o $@
|
||||
|
||||
test_qmckl_shared: test_qmckl.c $(qmckl_h) $(shared_lib) $(TESTS) $(TESTS_F)
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) \
|
||||
-Wl,-rpath,$(top_srcdir)/lib -L$(top_srcdir)/lib $(munit) $(TESTS) \
|
||||
$(TESTS_F) -lqmckl $(LIBS) $(FCLIBS) test_qmckl.c -o $@
|
||||
|
||||
check: test_qmckl test_qmckl_shared
|
||||
./test_qmckl
|
||||
|
||||
clean:
|
||||
$(RM) -- *.o *.mod $(shared_lib) $(static_lib) test_qmckl
|
||||
|
||||
|
||||
|
||||
|
||||
install:
|
||||
install -d $(DESTDIR)$(prefix)/lib
|
||||
install -d $(DESTDIR)$(prefix)/include
|
||||
install -d $(DESTDIR)$(prefix)/share/qmckl/fortran
|
||||
install -d $(DESTDIR)$(prefix)/share/doc/qmckl/html/
|
||||
install -d $(DESTDIR)$(prefix)/share/doc/qmckl/text/
|
||||
install $(shared_lib) $(DESTDIR)$(libdir)/
|
||||
install $(static_lib) $(DESTDIR)$(libdir)/
|
||||
install $(qmckl_h) $(DESTDIR)$(includedir)
|
||||
install $(qmckl_f) $(DESTDIR)$(fortrandir)
|
||||
install $(top_srcdir)/share/doc/qmckl/html/*.html $(DESTDIR)$(docdir)/html/
|
||||
install $(top_srcdir)/share/doc/qmckl/html/*.css $(DESTDIR)$(docdir)/html/
|
||||
install $(top_srcdir)/share/doc/qmckl/text/*.txt $(DESTDIR)$(docdir)/text/
|
||||
|
||||
uninstall:
|
||||
rm $(DESTDIR)$(libdir)/libqmckl.so
|
||||
rm $(DESTDIR)$(libdir)/libqmckl.a
|
||||
rm $(DESTDIR)$(includedir)/qmckl.h
|
||||
rm -rf $(DESTDIR)$(datarootdir)/$(package)
|
||||
rm -rf $(DESTDIR)$(docdir)
|
||||
|
||||
.SUFFIXES: .c .f90 .o
|
||||
|
||||
.c.o:
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) -c $*.c -o $*.o
|
||||
|
||||
.f90.o: qmckl_f.o
|
||||
$(FC) $(FCFLAGS) -c $*.f90 -o $*.o
|
||||
|
||||
.PHONY: check cppcheck clean all
|
||||
|
||||
1031
src/Makefile.in
1031
src/Makefile.in
File diff suppressed because it is too large
Load Diff
@ -1,10 +1,5 @@
|
||||
#!/bin/bash
|
||||
# Script to build the documentation
|
||||
# :PROPERTIES:
|
||||
# :header-args:bash: :tangle build_doc.sh :noweb yes :shebang #!/bin/bash :comments org
|
||||
# :END:
|
||||
|
||||
# First define readonly global variables.
|
||||
|
||||
|
||||
readonly DOCS=${top_srcdir}/share/doc/qmckl/
|
||||
@ -15,11 +10,12 @@ readonly CONFIG_TANGLE=${top_srcdir}/tools/config_tangle.el
|
||||
|
||||
|
||||
|
||||
# Check that all the defined global variables correspond to files.
|
||||
|
||||
|
||||
function check_preconditions()
|
||||
{
|
||||
# Checks that all the defined global variables correspond to files.
|
||||
|
||||
if [[ -z ${top_srcdir} ]]
|
||||
then
|
||||
print "top_srcdir is not defined"
|
||||
@ -47,12 +43,11 @@ function check_preconditions()
|
||||
|
||||
|
||||
|
||||
# ~install_htmlize~ installs the htmlize Emacs plugin if the
|
||||
# =htmlize.el= file is not present.
|
||||
|
||||
|
||||
function install_htmlize()
|
||||
{
|
||||
# Installs the htmlize Emacs plugin if the =htmlize.el= file is not present.
|
||||
|
||||
local url="https://github.com/hniksic/emacs-htmlize"
|
||||
local repo="emacs-htmlize"
|
||||
|
||||
@ -71,11 +66,10 @@ function install_htmlize()
|
||||
|
||||
|
||||
|
||||
# Extract documentation from an org-mode file.
|
||||
|
||||
|
||||
function extract_doc()
|
||||
{
|
||||
# Extracts documentation from an org-mode file.
|
||||
|
||||
local org=$1
|
||||
local local_html=${SRC}/${org%.org}.html
|
||||
local local_text=${SRC}/${org%.org}.txt
|
||||
@ -100,8 +94,6 @@ function extract_doc()
|
||||
|
||||
|
||||
|
||||
# The main function of the script.
|
||||
|
||||
|
||||
function main() {
|
||||
|
||||
|
||||
@ -1,13 +1,5 @@
|
||||
#!/bin/bash
|
||||
# Script to build the final qmckl.h file
|
||||
# :PROPERTIES:
|
||||
# :header-args:bash: :tangle build_qmckl_h.sh :noweb yes :shebang #!/bin/bash :comments org
|
||||
# :END:
|
||||
|
||||
|
||||
# This file was created by tools/Building.org
|
||||
|
||||
|
||||
|
||||
# All the produced header files are concatenated in the =qmckl.h=
|
||||
# file, located in the include directory. The =*_private.h= files
|
||||
@ -32,7 +24,7 @@ done
|
||||
# Generate C header file
|
||||
|
||||
|
||||
OUTPUT="${top_srcdir}/include/qmckl.h"
|
||||
OUTPUT="qmckl.h"
|
||||
|
||||
cat << EOF > ${OUTPUT}
|
||||
/*
|
||||
@ -105,7 +97,7 @@ EOF
|
||||
HEADERS_TYPE="qmckl_*_fh_type.f90"
|
||||
HEADERS="qmckl_*_fh_func.f90"
|
||||
|
||||
OUTPUT="${top_srcdir}/share/qmckl/fortran/qmckl_f.f90"
|
||||
OUTPUT="qmckl_f.f90"
|
||||
cat << EOF > ${OUTPUT}
|
||||
!
|
||||
! ------------------------------------------
|
||||
|
||||
@ -1,180 +1,146 @@
|
||||
#!/bin/bash
|
||||
# Script to generate auto-generated Makefile
|
||||
# :PROPERTIES:
|
||||
# :header-args: :tangle create_makefile.sh :noweb yes :shebang #!/bin/bash :comments org
|
||||
# :END:
|
||||
|
||||
# This script generates the Makefile that compiles the library.
|
||||
# The ~OUTPUT~ variable contains the name of the generated Makefile,typically
|
||||
# =Makefile.generated=.
|
||||
|
||||
|
||||
# This file was created by tools/Building.org
|
||||
function org_files() {
|
||||
echo ORG_FILES=$(echo *.org)
|
||||
}
|
||||
|
||||
declare -A DEPS
|
||||
|
||||
C_FILES=
|
||||
F_FILES=
|
||||
FH_FUNC_FILES=
|
||||
FH_TYPE_FILES=
|
||||
H_FUNC_FILES=
|
||||
H_TYPE_FILES=
|
||||
H_PRIVATE_FUNC_FILES=
|
||||
H_PRIVATE_TYPE_FILES=
|
||||
C_TEST_FILES=
|
||||
F_TEST_FILES=
|
||||
|
||||
for org in qmckl_*.org ; do
|
||||
i=${org%.org}
|
||||
c=${i}.c
|
||||
h_func=${i}_func.h
|
||||
h_type=${i}_type.h
|
||||
h_private_func=${i}_private_func.h
|
||||
h_private_type=${i}_private_type.h
|
||||
f90=${i}_f.f90
|
||||
fh_func=${i}_fh_func.f90
|
||||
fh_type=${i}_fh_type.f90
|
||||
|
||||
grep -q "(eval c)" $org
|
||||
if [[ $? -eq 0 ]] ; then
|
||||
DEPS["$c"]+=" $org"
|
||||
C_FILES+=" $c"
|
||||
fi
|
||||
|
||||
grep -q "(eval h_func)" $org
|
||||
if [[ $? -eq 0 ]] ; then
|
||||
DEPS[$h_func]+=" $org"
|
||||
DEPS[$c]+=" $h_func"
|
||||
H_FUNC_FILES+=" $h_func"
|
||||
fi
|
||||
|
||||
grep -q "(eval h_type)" $org
|
||||
if [[ $? -eq 0 ]] ; then
|
||||
DEPS[$h_type]+=" $org"
|
||||
DEPS[$c]+=" $h_type"
|
||||
H_TYPE_FILES+=" $h_type"
|
||||
fi
|
||||
|
||||
grep -q "(eval h_private_type)" $org
|
||||
if [[ $? -eq 0 ]] ; then
|
||||
DEPS[$h_private_type]+=" $org"
|
||||
DEPS[$c]+=" $h_private_type"
|
||||
H_PRIVATE_TYPE_FILES+=" $h_private_type"
|
||||
fi
|
||||
|
||||
grep -q "(eval h_private_func)" $org
|
||||
if [[ $? -eq 0 ]] ; then
|
||||
DEPS[$h_private_func]+=" $org"
|
||||
DEPS[$c]+=" $h_private_func"
|
||||
H_PRIVATE_FUNC_FILES+=" $h_private_func"
|
||||
fi
|
||||
|
||||
grep -q "(eval f)" $org
|
||||
if [[ $? -eq 0 ]] ; then
|
||||
DEPS[$f90]+=" $org"
|
||||
F_FILES+=" $f90"
|
||||
fi
|
||||
|
||||
grep -q "(eval fh_func)" $org
|
||||
if [[ $? -eq 0 ]] ; then
|
||||
DEPS[$fh_func]+=" $org"
|
||||
DEPS[$f90]+=" $fh_func"
|
||||
FH_FUNC_FILES+=" $fh_func"
|
||||
fi
|
||||
|
||||
grep -q "(eval fh_type)" $org
|
||||
if [[ $? -eq 0 ]] ; then
|
||||
DEPS[$fh_type]+=" $org"
|
||||
DEPS[$f90]+=" $fh_type"
|
||||
FH_TYPE_FILES+=" $fh_type"
|
||||
fi
|
||||
done
|
||||
|
||||
for org in qmckl_*.org ; do
|
||||
i=${org%.org}
|
||||
c=${i}.c
|
||||
f90=${i}.f90
|
||||
c_test=test_${i}.c
|
||||
f_test=test_${i}_f.f90
|
||||
grep -q "(eval c_test)" $org
|
||||
if [[ $? -eq 0 ]] ; then
|
||||
DEPS[$c_test]+=" $org ${DEPS[$c]}"
|
||||
C_TEST_FILES+=" $c_test"
|
||||
fi
|
||||
|
||||
grep -q "(eval f_test)" $org
|
||||
if [[ $? -eq 0 ]] ; then
|
||||
DEPS[$f_test]+=" $org ${DEPS[$f90]}"
|
||||
F_TEST_FILES+=" $f_test"
|
||||
fi
|
||||
done
|
||||
|
||||
for org in ${ORG_FILES} ; do
|
||||
i=${org%.org}
|
||||
c=${i}.c
|
||||
f90=${i}.f90
|
||||
for f in ${!DEPS[@]} ; do
|
||||
extension="${f##*.}"
|
||||
grep -q "$f" $org
|
||||
if [[ $? -ne 0 ]] ; then
|
||||
if [[ extension == ".h" ]] ; then
|
||||
DEPS[$c]+=" $f"
|
||||
elif [[ extension == ".f90" ]] ; then
|
||||
DEPS[$f90]+=" $f"
|
||||
fi
|
||||
fi
|
||||
done
|
||||
done
|
||||
|
||||
for f in ${!DEPS[@]} ; do
|
||||
if [[ "${f/_f.f90/_f.f90x}" == "${f}x" ]] ; then
|
||||
DEPS["$f"]+=" qmckl_f.o"
|
||||
fi
|
||||
done
|
||||
|
||||
echo > generated.mk
|
||||
echo "C_FILES=${C_FILES}" >> generated.mk
|
||||
echo "F_FILES=${F_FILES}" >> generated.mk
|
||||
echo "FH_FUNC_FILES=${FH_FUNC_FILES}" >> generated.mk
|
||||
echo "FH_TYPE_FILES=${FH_TYPE_FILES}" >> generated.mk
|
||||
echo "H_FUNC_FILES=${H_FUNC_FILES}" >> generated.mk
|
||||
echo "H_TYPE_FILES=${H_TYPE_FILES}" >> generated.mk
|
||||
echo "H_PRIVATE_FUNC_FILES=${H_PRIVATE_FUNC_FILES}" >> generated.mk
|
||||
echo "H_PRIVATE_TYPE_FILES=${H_PRIVATE_TYPE_FILES}" >> generated.mk
|
||||
echo "C_TEST_FILES=${C_TEST_FILES}" >> generated.mk
|
||||
echo "F_TEST_FILES=${F_TEST_FILES}" >> generated.mk
|
||||
echo >> generated.mk
|
||||
|
||||
for f in ${!DEPS[@]} ; do
|
||||
echo ${f}: ${DEPS[$f]}
|
||||
done | sort >> generated.mk
|
||||
|
||||
|
||||
|
||||
OUTPUT=Makefile.generated.in
|
||||
|
||||
|
||||
|
||||
# We start by tangling all the org-mode files.
|
||||
|
||||
|
||||
${top_srcdir}/tools/tangle.sh *.org
|
||||
${top_srcdir}/tools/build_qmckl_h.sh
|
||||
|
||||
|
||||
|
||||
# Then we create the list of ~*.o~ files to be created, for library
|
||||
# functions:
|
||||
|
||||
|
||||
OBJECTS="qmckl_f.o"
|
||||
for i in $(ls qmckl_*.c qmckl_*f.f90) ; do
|
||||
FILE=${i%.*}
|
||||
OBJECTS+=" ${FILE}.o"
|
||||
done >> $OUTPUT
|
||||
|
||||
|
||||
|
||||
# for tests in C:
|
||||
|
||||
|
||||
TESTS=""
|
||||
for i in $(ls test_qmckl_*.c) ; do
|
||||
FILE=${i%.c}
|
||||
TESTS+=" ${FILE}.o"
|
||||
done >> $OUTPUT
|
||||
|
||||
|
||||
|
||||
# and for tests in Fortran:
|
||||
|
||||
|
||||
TESTS_F=""
|
||||
for i in $(ls test_qmckl_*_f.f90) ; do
|
||||
FILE=${i%.f90}
|
||||
TESTS_F+=" ${FILE}.o"
|
||||
done >> $OUTPUT
|
||||
|
||||
|
||||
|
||||
# Finally, we append the variables to the Makefile
|
||||
|
||||
|
||||
cat << EOF > ${OUTPUT}
|
||||
.POSIX:
|
||||
.SUFFIXES:
|
||||
|
||||
package = @PACKAGE_TARNAME@
|
||||
version = @PACKAGE_VERSION@
|
||||
|
||||
# VPATH-related substitution variables
|
||||
srcdir = @srcdir@
|
||||
VPATH = @srcdir@
|
||||
|
||||
prefix = @prefix@
|
||||
|
||||
CC = @CC@
|
||||
DEFS = @DEFS@
|
||||
CFLAGS = @CFLAGS@ -I\$(top_srcdir)/munit/ -I\$(top_srcdir)/include -I.
|
||||
CPPFLAGS = @CPPFLAGS@
|
||||
LIBS = @LIBS@
|
||||
|
||||
FC = @FC@
|
||||
FCFLAGS= @FCFLAGS@
|
||||
|
||||
OBJECT_FILES=$OBJECTS
|
||||
|
||||
TESTS = $TESTS
|
||||
TESTS_F = $TESTS_F
|
||||
|
||||
LIBS = @LIBS@
|
||||
FCLIBS = @FCLIBS@
|
||||
EOF
|
||||
|
||||
export
|
||||
echo '
|
||||
top_srcdir=$(srcdir)/..
|
||||
shared_lib=$(top_srcdir)/lib/libqmckl.so
|
||||
static_lib=$(top_srcdir)/lib/libqmckl.a
|
||||
qmckl_h=$(top_srcdir)/include/qmckl.h
|
||||
qmckl_f=$(top_srcdir)/share/qmckl/fortran/qmckl_f.f90
|
||||
munit=$(top_srcdir)/munit/munit.c
|
||||
|
||||
datarootdir=$(prefix)/share
|
||||
datadir=$(datarootdir)
|
||||
docdir=$(datarootdir)/doc/$(package)
|
||||
htmldir=$(docdir)/html
|
||||
libdir=$(prefix)/lib
|
||||
includedir=$(prefix)/include
|
||||
fortrandir=$(datarootdir)/$(package)/fortran
|
||||
|
||||
|
||||
shared: $(shared_lib)
|
||||
static: $(static_lib)
|
||||
|
||||
|
||||
all: shared static
|
||||
|
||||
$(shared_lib): $(OBJECT_FILES)
|
||||
$(CC) -shared $(OBJECT_FILES) -o $(shared_lib)
|
||||
|
||||
$(static_lib): $(OBJECT_FILES)
|
||||
$(AR) rcs $(static_lib) $(OBJECT_FILES)
|
||||
|
||||
|
||||
# Test
|
||||
|
||||
qmckl_f.o: $(qmckl_f)
|
||||
$(FC) $(FCFLAGS) -c $(qmckl_f) -o $@
|
||||
|
||||
test_qmckl: test_qmckl.c $(qmckl_h) $(static_lib) $(TESTS) $(TESTS_F)
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) $(munit) $(TESTS) $(TESTS_F) \
|
||||
$(static_lib) $(LIBS) $(FCLIBS) test_qmckl.c -o $@
|
||||
|
||||
test_qmckl_shared: test_qmckl.c $(qmckl_h) $(shared_lib) $(TESTS) $(TESTS_F)
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) \
|
||||
-Wl,-rpath,$(top_srcdir)/lib -L$(top_srcdir)/lib $(munit) $(TESTS) \
|
||||
$(TESTS_F) -lqmckl $(LIBS) $(FCLIBS) test_qmckl.c -o $@
|
||||
|
||||
check: test_qmckl test_qmckl_shared
|
||||
./test_qmckl
|
||||
|
||||
clean:
|
||||
$(RM) -- *.o *.mod $(shared_lib) $(static_lib) test_qmckl
|
||||
|
||||
|
||||
|
||||
|
||||
install:
|
||||
install -d $(DESTDIR)$(prefix)/lib
|
||||
install -d $(DESTDIR)$(prefix)/include
|
||||
install -d $(DESTDIR)$(prefix)/share/qmckl/fortran
|
||||
install -d $(DESTDIR)$(prefix)/share/doc/qmckl/html/
|
||||
install -d $(DESTDIR)$(prefix)/share/doc/qmckl/text/
|
||||
install $(shared_lib) $(DESTDIR)$(libdir)/
|
||||
install $(static_lib) $(DESTDIR)$(libdir)/
|
||||
install $(qmckl_h) $(DESTDIR)$(includedir)
|
||||
install $(qmckl_f) $(DESTDIR)$(fortrandir)
|
||||
install $(top_srcdir)/share/doc/qmckl/html/*.html $(DESTDIR)$(docdir)/html/
|
||||
install $(top_srcdir)/share/doc/qmckl/html/*.css $(DESTDIR)$(docdir)/html/
|
||||
install $(top_srcdir)/share/doc/qmckl/text/*.txt $(DESTDIR)$(docdir)/text/
|
||||
|
||||
uninstall:
|
||||
rm $(DESTDIR)$(libdir)/libqmckl.so
|
||||
rm $(DESTDIR)$(libdir)/libqmckl.a
|
||||
rm $(DESTDIR)$(includedir)/qmckl.h
|
||||
rm -rf $(DESTDIR)$(datarootdir)/$(package)
|
||||
rm -rf $(DESTDIR)$(docdir)
|
||||
|
||||
.SUFFIXES: .c .f90 .o
|
||||
|
||||
.c.o:
|
||||
$(CC) $(CFLAGS) $(CPPFLAGS) $(DEFS) -c $*.c -o $*.o
|
||||
|
||||
.f90.o: qmckl_f.o
|
||||
$(FC) $(FCFLAGS) -c $*.f90 -o $*.o
|
||||
|
||||
.PHONY: check cppcheck clean all
|
||||
' >> ${OUTPUT}
|
||||
|
||||
@ -1,8 +0,0 @@
|
||||
#!/bin/bash
|
||||
|
||||
OUTPUT=$1
|
||||
|
||||
for i in README.org $(cat $QMCKL_ROOT/src/table_of_contents)
|
||||
do
|
||||
cat $i >> $1
|
||||
done
|
||||
@ -1,23 +1,17 @@
|
||||
#!/bin/bash
|
||||
# Script to tangle the org-mode files
|
||||
# :PROPERTIES:
|
||||
# :header-args: :tangle tangle.sh :noweb yes :shebang #!/bin/bash :comments org
|
||||
# :END:
|
||||
#
|
||||
# This script tangles all the org-mode files in the src directory of QMCkl.
|
||||
# It needs to be run from in the src directory. It uses the config_tangle.el
|
||||
# Emacs configuration file, which contains information required to compute the
|
||||
# current file names using for example ~(eval c)~ to get the name of the
|
||||
# produced C file. The org-mode file is not tangled if the last modification
|
||||
# date of the org file is older than one of the tangled files.
|
||||
# The =missing= script is used to check if emacs is present on the system.
|
||||
|
||||
|
||||
# This file was created by tools/Building.org
|
||||
|
||||
|
||||
|
||||
# This file needs to be run from the QMCKL =src= directory.
|
||||
|
||||
# It tangles all the files in the directory. It uses the
|
||||
# =config_tangle.el= file, which contains information required to
|
||||
# compute the current file names using for example ~(eval c)~ to get
|
||||
# the name of the produced C file.
|
||||
|
||||
# The file is not tangled if the last modification date of the org
|
||||
# file is less recent than one of the tangled files.
|
||||
if [[ $(basename $PWD) != "src" ]] ; then
|
||||
print "Error: $0 needs to be run from src directory"
|
||||
exit 1
|
||||
fi
|
||||
|
||||
|
||||
function tangle()
|
||||
@ -31,11 +25,14 @@ function tangle()
|
||||
elif [[ ${org_file} -ot ${f_file} ]] ; then
|
||||
return
|
||||
fi
|
||||
emacs --batch ${org_file} --load=${top_srcdir}/tools/config_tangle.el -f org-babel-tangle
|
||||
../missing \
|
||||
emacs --batch ${org_file} \
|
||||
--load=${top_srcdir}/tools/config_tangle.el \
|
||||
-f org-babel-tangle
|
||||
}
|
||||
|
||||
for i in $@
|
||||
do
|
||||
echo "--- ${i} ----"
|
||||
# echo "--- ${i} ----"
|
||||
tangle ${i}
|
||||
done
|
||||
|
||||
Loading…
Reference in New Issue
Block a user