diff --git a/.gitignore b/.gitignore index c8af45e..25a593d 100644 --- a/.gitignore +++ b/.gitignore @@ -1 +1,2 @@ +mpqc-2.3.1-mdv-fix-wfn-lib.patch mpqc-2.3.1.tar.bz2 diff --git a/bash-script-noarch b/bash-script-noarch deleted file mode 100755 index f1bfefd..0000000 --- a/bash-script-noarch +++ /dev/null @@ -1,3 +0,0 @@ -#!/bin/sh - -exec @BINARY@-$(arch) "$@" diff --git a/mpqc-2.3.1-c23-function-prototype.patch b/mpqc-2.3.1-c23-function-prototype.patch deleted file mode 100644 index 93db296..0000000 --- a/mpqc-2.3.1-c23-function-prototype.patch +++ /dev/null @@ -1,74 +0,0 @@ -diff --git a/src/lib/math/isosurf/implicit.c b/src/lib/math/isosurf/implicit.c -index c02a0e1..bf37f5c 100644 ---- a/src/lib/math/isosurf/implicit.c -+++ b/src/lib/math/isosurf/implicit.c -@@ -124,8 +124,8 @@ typedef struct intlists { /* list of list of integers */ - } INTLISTS; - - typedef struct process { /* parameters, function, storage */ -- double (*function)(); /* implicit surface function */ -- int (*triproc)(); /* triangle output function */ -+ double (*function)(double, double, double); /* implicit surface function */ -+ int (*triproc)(int, int, int, VERTICES); /* triangle output function */ - double size, delta; /* cube size, normal delta */ - int bounds; /* cube range within lattice */ - POINT start; /* start point on surface */ -@@ -136,14 +136,12 @@ typedef struct process { /* parameters, function, storage */ - EDGELIST **edges; /* edge and vertex id hash table */ - } PROCESS; - --void *calloc(); -- - #define mycalloc(n,nbyte) _mycalloc(n,nbyte,__LINE__) - #define myfree(ptr) _myfree(ptr,__LINE__) - - static void makecubetable (); - static void free_cubetable(); --static void converge(POINT*,POINT*,double,double(*f)(),POINT*); -+static void converge(POINT*,POINT*,double,double(*f)(double, double, double),POINT*); - static CORNER *setcorner (PROCESS*, int, int, int); - static int setcenter(CENTERLIST *table[], int, int, int); - static int dotet (CUBE*, int, int, int, int, PROCESS*); -@@ -231,7 +229,7 @@ VERTICES vertices; - - main () - { -- char *err, *polygonize(); -+ char *err; - - keepaspect(1, 1); - winopen("implicit"); -@@ -346,13 +344,12 @@ main () - */ - - char *polygonize (function, size, bounds, x, y, z, triproc, mode) --double (*function)(), size, x, y, z; --int bounds, (*triproc)(), mode; -+double (*function)(double, double, double), size, x, y, z; -+int bounds, (*triproc)(int, int, int, VERTICES), mode; - { - PROCESS p; - int n, noabort; -- CORNER *setcorner(); -- TEST in, out, find(); -+ TEST in, out; - - p.function = function; - p.triproc = triproc; -@@ -499,7 +496,6 @@ int i, j, k, face, c1, c2, c3, c4; - { - CUBE new; - CUBES *oldcubes = p->cubes; -- CORNER *setcorner(); - int n, pos = old->corners[c1]->value > 0.0 ? 1 : 0; - /* static int facebit[6] = {2, 2, 1, 1, 0, 0}; */ - /* int bit = facebit[face]; */ -@@ -1015,7 +1011,7 @@ PROCESS *p; - - static void converge (p1, p2, v, function, p) - double v; --double (*function)(); -+double (*function)(double, double, double); - POINT *p1, *p2, *p; - { - int i = 0; diff --git a/mpqc-2.3.1-cpp11-constexpr.patch b/mpqc-2.3.1-cpp11-constexpr.patch deleted file mode 100644 index 66ba4ac..0000000 --- a/mpqc-2.3.1-cpp11-constexpr.patch +++ /dev/null @@ -1,17 +0,0 @@ ---- mpqc-2.3.1/src/lib/chemistry/qc/mbptr12/transform_tbint.h.cpp11 2005-07-12 07:52:34.000000000 +0900 -+++ mpqc-2.3.1/src/lib/chemistry/qc/mbptr12/transform_tbint.h 2016-04-24 18:02:54.275499008 +0900 -@@ -61,7 +61,13 @@ class TwoBodyMOIntsTransform : virtual p - protected: - /** By default, integrals smaller than zero_integral are considered zero. - This constant is only used in checking integrals, not computing them. */ -- static const double zero_integral = 1.0e-12; -+ static -+#if __cplusplus >= 201103L -+ constexpr -+#else -+ const -+#endif -+ double zero_integral = 1.0e-12; - /// Predefined enumerated type for the MO spaces - typedef struct { - enum {Space1, Space2, Space3, Space4}; diff --git a/mpqc-2.3.1-cpp17-exception-specification.patch b/mpqc-2.3.1-cpp17-exception-specification.patch deleted file mode 100644 index 5afd1db..0000000 --- a/mpqc-2.3.1-cpp17-exception-specification.patch +++ /dev/null @@ -1,91 +0,0 @@ -diff --git a/src/lib/chemistry/qc/mbptr12/transform_ijxy.cc b/src/lib/chemistry/qc/mbptr12/transform_ijxy.cc -index 2b45d3b..a25e5f9 100644 ---- a/src/lib/chemistry/qc/mbptr12/transform_ijxy.cc -+++ b/src/lib/chemistry/qc/mbptr12/transform_ijxy.cc -@@ -174,7 +174,7 @@ TwoBodyMOIntsTransform_ijxy::init_acc() - } - - void --TwoBodyMOIntsTransform_ijxy::check_int_symm(double threshold) const throw (ProgrammingError) -+TwoBodyMOIntsTransform_ijxy::check_int_symm(double threshold) const /*throw (ProgrammingError)*/ - { - Ref iacc = ints_acc(); - if (!iacc->is_committed()) -diff --git a/src/lib/chemistry/qc/mbptr12/transform_ijxy.h b/src/lib/chemistry/qc/mbptr12/transform_ijxy.h -index 3407cb3..ecb61c6 100644 ---- a/src/lib/chemistry/qc/mbptr12/transform_ijxy.h -+++ b/src/lib/chemistry/qc/mbptr12/transform_ijxy.h -@@ -70,7 +70,7 @@ public: - /// Computes transformed integrals - void compute(); - /// Check symmetry of transformed integrals -- void check_int_symm(double threshold = TwoBodyMOIntsTransform::zero_integral) const throw (ProgrammingError); -+ void check_int_symm(double threshold = TwoBodyMOIntsTransform::zero_integral) const /*throw (ProgrammingError)*/; - }; - - } -diff --git a/src/lib/chemistry/qc/mbptr12/transform_ikjy.cc b/src/lib/chemistry/qc/mbptr12/transform_ikjy.cc -index ccb8d45..43c2fb6 100644 ---- a/src/lib/chemistry/qc/mbptr12/transform_ikjy.cc -+++ b/src/lib/chemistry/qc/mbptr12/transform_ikjy.cc -@@ -175,7 +175,7 @@ TwoBodyMOIntsTransform_ikjy::init_acc() - } - - void --TwoBodyMOIntsTransform_ikjy::check_int_symm(double threshold) const throw (ProgrammingError) -+TwoBodyMOIntsTransform_ikjy::check_int_symm(double threshold) const /*throw (ProgrammingError)*/ - { - Ref iacc = ints_acc(); - if (!iacc->is_committed()) -diff --git a/src/lib/chemistry/qc/mbptr12/transform_ikjy.h b/src/lib/chemistry/qc/mbptr12/transform_ikjy.h -index 5697813..4be38e4 100644 ---- a/src/lib/chemistry/qc/mbptr12/transform_ikjy.h -+++ b/src/lib/chemistry/qc/mbptr12/transform_ikjy.h -@@ -70,7 +70,7 @@ public: - /// Computes transformed integrals - void compute(); - /// Check symmetry of transformed integrals -- void check_int_symm(double threshold = TwoBodyMOIntsTransform::zero_integral) const throw (ProgrammingError); -+ void check_int_symm(double threshold = TwoBodyMOIntsTransform::zero_integral) const /*throw (ProgrammingError)*/; - }; - - } -diff --git a/src/lib/chemistry/qc/mbptr12/transform_ixjy.cc b/src/lib/chemistry/qc/mbptr12/transform_ixjy.cc -index 2548296..b4f08cd 100644 ---- a/src/lib/chemistry/qc/mbptr12/transform_ixjy.cc -+++ b/src/lib/chemistry/qc/mbptr12/transform_ixjy.cc -@@ -182,7 +182,7 @@ TwoBodyMOIntsTransform_ixjy::init_acc() - } - - void --TwoBodyMOIntsTransform_ixjy::check_int_symm(double threshold) const throw (ProgrammingError) -+TwoBodyMOIntsTransform_ixjy::check_int_symm(double threshold) const /*throw (ProgrammingError)*/ - { - Ref iacc = ints_acc(); - if (!iacc->is_committed()) -diff --git a/src/lib/chemistry/qc/mbptr12/transform_ixjy.h b/src/lib/chemistry/qc/mbptr12/transform_ixjy.h -index 8fda231..a10e4ef 100644 ---- a/src/lib/chemistry/qc/mbptr12/transform_ixjy.h -+++ b/src/lib/chemistry/qc/mbptr12/transform_ixjy.h -@@ -71,7 +71,7 @@ public: - /// Computes transformed integrals - void compute(); - /// Check symmetry of transformed integrals -- void check_int_symm(double threshold = TwoBodyMOIntsTransform::zero_integral) const throw (ProgrammingError); -+ void check_int_symm(double threshold = TwoBodyMOIntsTransform::zero_integral) const /*throw (ProgrammingError)*/; - }; - - } -diff --git a/src/lib/chemistry/qc/mbptr12/transform_tbint.h b/src/lib/chemistry/qc/mbptr12/transform_tbint.h -index 731a53c..57e4e19 100644 ---- a/src/lib/chemistry/qc/mbptr12/transform_tbint.h -+++ b/src/lib/chemistry/qc/mbptr12/transform_tbint.h -@@ -196,7 +196,7 @@ public: - /// Computes transformed integrals - virtual void compute() = 0; - /// Check symmetry of transformed integrals -- virtual void check_int_symm(double threshold = TwoBodyMOIntsTransform::zero_integral) const throw (ProgrammingError) =0; -+ virtual void check_int_symm(double threshold = TwoBodyMOIntsTransform::zero_integral) const /*throw (ProgrammingError)*/ =0; - /// Make the transform obsolete. Next call to compute() will recompute - virtual void obsolete(); - diff --git a/mpqc-2.3.1-cpp20-std_istream-redirect.patch b/mpqc-2.3.1-cpp20-std_istream-redirect.patch deleted file mode 100644 index 54c3ab0..0000000 --- a/mpqc-2.3.1-cpp20-std_istream-redirect.patch +++ /dev/null @@ -1,29 +0,0 @@ ---- mpqc-2.3.1/src/lib/util/state/state_text.cc.cpp20 2002-10-11 04:58:21.000000000 +0900 -+++ mpqc-2.3.1/src/lib/util/state/state_text.cc 2026-01-15 14:40:20.392566622 +0900 -@@ -138,6 +138,7 @@ StateInText::no_array() - - /////////////////////////////////////////////////////////////////////// - -+/* - int - StateInText::read(char*s) - { -@@ -149,6 +150,7 @@ StateInText::read(char*s) - } - return strlen(s)+1; - } -+*/ - - int - StateInText::read(unsigned int&i) ---- mpqc-2.3.1/src/lib/util/state/state_text.h.cpp20 2002-04-03 15:44:40.000000000 +0900 -+++ mpqc-2.3.1/src/lib/util/state/state_text.h 2026-01-15 14:40:28.004235129 +0900 -@@ -94,7 +94,7 @@ class StateInText: public StateInFile { - void no_newline(); - void no_array(); - -- int read(char*); -+ /* int read(char*); */ - int read(unsigned int&); - int read(int&); - int read(float&); diff --git a/mpqc-2.3.1-format-security.patch b/mpqc-2.3.1-format-security.patch deleted file mode 100644 index 7f253ff..0000000 --- a/mpqc-2.3.1-format-security.patch +++ /dev/null @@ -1,13 +0,0 @@ -diff --git a/src/lib/chemistry/molecule/atominfo.cc b/src/lib/chemistry/molecule/atominfo.cc -index de75dcd..a0a60c9 100644 ---- a/src/lib/chemistry/molecule/atominfo.cc -+++ b/src/lib/chemistry/molecule/atominfo.cc -@@ -493,7 +493,7 @@ AtomInfo::string_to_Z(const std::string &name, int allow_exceptions) - if (iname != symbol_to_Z_.end()) return iname->second; - - if (allow_exceptions) { -- ExEnv::err0() << sprintf("AtomInfo: invalid name: %s\n",name.c_str()); -+ ExEnv::err0() << scprintf("AtomInfo: invalid name: %s\n",name.c_str()); - throw std::runtime_error("invalid atom name"); - } - diff --git a/mpqc-2.3.1-mdv-fix-wfn-lib.patch b/mpqc-2.3.1-mdv-fix-wfn-lib.patch deleted file mode 100644 index ab6b0a8..0000000 --- a/mpqc-2.3.1-mdv-fix-wfn-lib.patch +++ /dev/null @@ -1,29 +0,0 @@ ---- a/bin/listlibs.pl 2009-10-15 17:28:45.000000000 +0200 -+++ b/bin/listlibs.pl 2009-10-15 17:33:35.000000000 +0200 -@@ -183,7 +183,7 @@ - sub process_directory { - local ($dir) = shift; - opendir(DIR,"$dir"); -- local (@files) = readdir(DIR); -+ local (@files) = sort readdir(DIR); - closedir(DIR); - local ($i); - foreach $i (@files) { ---- a/src/lib/chemistry/qc/dft/LIBS.h 2002-01-09 01:07:14.000000000 -0500 -+++ b/src/lib/chemistry/qc/dft/LIBS.h 2009-10-14 12:03:34.000000000 -0400 -@@ -1,6 +1,5 @@ - libSCdft.LIBSUF - #include --#include - #include - #include - ---- a/src/lib/chemistry/qc/scf/LIBS.h 2002-01-09 07:07:15.000000000 +0100 -+++ b/src/lib/chemistry/qc/scf/LIBS.h 2009-10-15 19:39:22.000000000 +0200 -@@ -1,6 +1,5 @@ - libSCscf.LIBSUF - #include --#include - #include - #include - #include diff --git a/mpqc.spec b/mpqc.spec index 4253eb1..033e967 100644 --- a/mpqc.spec +++ b/mpqc.spec @@ -1,32 +1,18 @@ Name: mpqc Summary: Ab-inito chemistry program Version: 2.3.1 -Release: 66%{?dist} -# Automatically converted from old format: GPLv2+ and LGPLv2+ - review is highly recommended. -License: GPL-2.0-or-later AND LicenseRef-Callaway-LGPLv2+ +Release: 14%{?dist} +License: GPLv2+ and LGPLv2+ +Group: Applications/Engineering URL: http://www.mpqc.org/ -Source0: http://downloads.sourceforge.net/mpqc/%{name}-%{version}.tar.bz2 -Source1: bash-script-noarch +Source: http://downloads.sourceforge.net/mpqc/%{name}-%{version}.tar.bz2 Patch0: mpqc-2.3.1-mdv-fix-wfn-lib.patch -Patch1: mpqc-2.3.1-format-security.patch -# C++11 build fix -Patch2: mpqc-2.3.1-cpp11-constexpr.patch -# C23 strict function prototype fix -Patch3: mpqc-2.3.1-c23-function-prototype.patch -# C++17 build fix: remove deprecated exception specification -Patch4: mpqc-2.3.1-cpp17-exception-specification.patch -# C++20 fix: std::istream operator>>(char *) removal -Patch5: mpqc-2.3.1-cpp20-std_istream-redirect.patch -Requires: %{name}-libs%{?_isa} = %{version}-%{release} -BuildRequires: make -BuildRequires: gcc-c++ -BuildRequires: libtool flex bison +Requires: %{name}-libs = %{version}-%{release} +BuildRequires: autoconf flex bison BuildRequires: desktop-file-utils -BuildRequires: gcc-gfortran perl-generators -BuildRequires: doxygen -BuildRequires: /usr/bin/wish -BuildRequires: libint-devel -BuildRequires: flexiblas-devel +BuildRequires: gcc-gfortran tk doxygen +BuildRequires: libint-devel atlas-devel +BuildRoot: %(mktemp -ud %{_tmppath}/%{name}-%{version}-%{release}-XXXXXX) %description MPQC is the Massively Parallel Quantum Chemistry Program. It computes @@ -38,7 +24,8 @@ oriented, using the C++ programming language. %package data Summary: Atom info and basis sets from MPQC -#Requires: %{name}-doc = %{version}-%{release} +Group: Applications/Engineering +Requires: %{name}-doc = %{version}-%{release} BuildArch: noarch %description data @@ -46,6 +33,7 @@ Atom info and basis sets from MPQC. %package doc Summary: HTML documentation for MPQC +Group: Applications/Engineering BuildArch: noarch %description doc @@ -54,9 +42,8 @@ with a graphical browser like Mozilla. %package libs Summary: Main libraries for %{name} +Group: Development/Libraries Requires: %{name}-data = %{version}-%{release} -# Libint can have API breakage between releases -Requires: libint(api)%{?_isa} = %{_libint_apiversion} %description libs This package contains the shared libraries needed to run programs @@ -65,7 +52,8 @@ based on mpqc computational chemistry package from Sandia Labs. %package devel Summary: Development headers and libraries for %{name} -Requires: %{name}-libs%{?_isa} = %{version}-%{release} +Group: Development/Libraries +Requires: %{name}-libs = %{version}-%{release} %description devel This package contains the header files and static libraries needed to @@ -74,26 +62,9 @@ based on mpqc computational chemistry package from Sandia Labs. %prep %setup -q -%patch -P0 -p1 -%patch -P1 -p1 -%patch -P2 -p1 -b .cpp11 -%patch -P3 -p1 -b .c23 -%patch -P4 -p1 -b .cpp17 -%patch -P5 -p1 -b .cpp20 - +%patch0 -p1 sed -i -e 's,molrender.in,%{_datadir}/molrender/molrender.in,g' src/bin/molrender/tkmolrender.in sed -i -e 's,prefix/lib,prefix/%{_lib},g' configure.in -# fixup for modern autoreconf -mv configure.in configure.ac -sed -i -r -e 's/AC_DEFINE\(([^)]*)\)/AC_DEFINE([\1],1,[\1])/g' configure.ac -sed -i -r -e 's/AC_DEFINE_UNQUOTED\(([^,]*),([^)]*)\)/AC_DEFINE_UNQUOTED([\1],\2,[\1])/g' configure.ac -sed -i -r -e 's/AC_DEFINE_DIR\(([^,]*),([^)]*)\)/AC_DEFINE_DIR([\1],\2,[\1])/g' configure.ac -sed -i -r -e 's/AC_CANONICAL_SYSTEM/AC_CANONICAL_SYSTEM\nAC_DEFINE([SHMTYPE], [void *], [data type for shmat])/g' configure.ac -sed -i -r -e 's/AC_DEFINE\(\[CXX_RESTRICT\],1,\[CXX_RESTRICT\]\)/AC_DEFINE([restrictxx],[restrict],[have restrict keyword]),AC_DEFINE([restrictxx],[],[do not have restrict keyword])/g' configure.ac -# Make configure.ac c99 conformant, -Werror=implicit-int -Werror=implicit-function-declaration -sed -i -e '\@main.*FF@s|main|extern void FF(void); int main|' configure.ac -rm -f lib/autoconf/libtool.m4 -# end autoreconf fixup cat >molrender.desktop << EOF [Desktop Entry] Name=Molrender @@ -108,14 +79,12 @@ EOF %build export F77=gfortran -autoreconf -v -f -i -I lib/autoconf - -%configure --enable-shared --disable-static \ - --enable-threads --disable-parallel \ +autoconf +%configure --enable-shared --enable-threads --disable-static --disable-parallel \ --includedir="%{_includedir}/mpqc" \ + --with-libdirs="-L%{_libdir}/atlas" \ --with-cxx-optflags="$CXXFLAGS" \ - --with-cc-optflags="$CFLAGS" \ - --with-libs="-lflexiblas" + --with-cc-optflags="$CFLAGS" sed -i 's|.rpath .libdir||g' bin/sc-config sed -i 's|^hardcode_libdir_flag_spec=.*|hardcode_libdir_flag_spec=""|g' libtool sed -i 's|^runpath_var=LD_RUN_PATH|runpath_var=DIE_RPATH_DIE|g' libtool @@ -126,6 +95,7 @@ make man1 make man3 %install +rm -rf %{buildroot} make installroot="%{buildroot}" INSTALL="install -p" install make installroot="%{buildroot}" INSTALL="install -p" install_devel # rename some man pages with sc_ prefix @@ -146,27 +116,15 @@ sed -i -e "1,1s,^.*$,#!/usr/bin/perl," %{buildroot}%{_bindir}/sc-mkf77sym sed -i -e "1,1s,^.*$,#!/usr/bin/perl -I%{_datadir}/mpqc/${_version}/perl," %{buildroot}%{_bindir}/chkmpqcout chmod 755 %{buildroot}%{_bindir}/chkmpqcout -# Fix up sc-config all_libs -sed -i %{buildroot}%{_bindir}/sc-config \ - -e 's|^LIBSUF=la$|LIBSUF=so|' \ - -e '\@all_sclibs@s|\(lib[^ \t][^ \t]*\)\.la|\1.so|g' \ - -e 's|-L[^ \t]*gcc[^ \t]*||g' \ - %{nil} +%clean +rm -rf %{buildroot} -# And rename arch-dependent script to arch-dependent name -for f in \ - sc-config \ - sc-libtool \ - %{nil} -do - mv %{buildroot}%{_bindir}/${f}{,-$(arch)} - cat %{SOURCE1} | sed -e "s|@BINARY@|$f|" > %{buildroot}%{_bindir}/${f} - chmod 0755 %{buildroot}%{_bindir}/${f} -done +%post libs -p /sbin/ldconfig -%ldconfig_scriptlets libs +%postun libs -p /sbin/ldconfig %files +%defattr(-,root,root,-) %doc CHANGES CITATION README %{_bindir}/mpqc %{_bindir}/chkmpqcout @@ -183,17 +141,21 @@ done %{_mandir}/man1/molrender* %files data +%defattr(-,root,root,-) %{_datadir}/mpqc -%license LICENSE COPYING COPYING.LIB %files doc +%defattr(-,root,root,-) %doc doc/html -%license LICENSE COPYING COPYING.LIB +%doc LICENSE COPYING COPYING.LIB %files libs +%defattr(-,root,root) +%doc LICENSE COPYING COPYING.LIB %{_libdir}/lib*.so.* %files devel +%defattr(-,root,root,-) %{_bindir}/sc-* %{_libdir}/lib*.so %{_includedir}/mpqc @@ -202,171 +164,6 @@ done %changelog -* Thu Jan 15 2026 Mamoru TASAKA - 2.3.1-66 -- c++20 fix for std::istream redirect operator change - -* Thu Jul 24 2025 Fedora Release Engineering - 2.3.1-65 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_43_Mass_Rebuild - -* Fri Jan 31 2025 Mamoru TASAKA - 2.3.1-64 -- Use wish instead of tk for BuildRequires -- F42: rebuild with wish in tk9 - -* Mon Jan 20 2025 Mamoru TASAKA - 2.3.1-63 -- Support C++17, remove deprecated exception specification - -* Sun Jan 19 2025 Mamoru TASAKA - 2.3.1-62 -- Support C23 strict function prototype - -* Fri Jan 17 2025 Fedora Release Engineering - 2.3.1-61 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_42_Mass_Rebuild - -* Mon Sep 02 2024 Miroslav Suchý - 2.3.1-60 -- convert license to SPDX - -* Thu Jul 18 2024 Fedora Release Engineering - 2.3.1-59 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_41_Mass_Rebuild - -* Fri May 31 2024 Mamoru TASAKA - 2.3.1-58 -- Update %%patch usage for recent rpm - -* Thu Jan 25 2024 Fedora Release Engineering - 2.3.1-57 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild - -* Sun Jan 21 2024 Fedora Release Engineering - 2.3.1-56 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild - -* Thu Jul 20 2023 Fedora Release Engineering - 2.3.1-55 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_39_Mass_Rebuild - -* Thu Jan 19 2023 Fedora Release Engineering - 2.3.1-54 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild - -* Sun Nov 27 2022 Mamoru TASAKA - 2.3.1-53 -- Make configure (wrt Fortran symbol detection) c99 conformant - for -Werror=implicit-int -Werror=implicit-function-declaration - -* Thu Jul 21 2022 Fedora Release Engineering - 2.3.1-52 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_37_Mass_Rebuild - -* Thu Jan 20 2022 Fedora Release Engineering - 2.3.1-51 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_36_Mass_Rebuild - -* Thu Jul 22 2021 Fedora Release Engineering - 2.3.1-50 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_35_Mass_Rebuild - -* Tue Jan 26 2021 Fedora Release Engineering - 2.3.1-49 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_34_Mass_Rebuild - -* Sun Aug 16 2020 Iñaki Úcar - 2.3.1-48 -- https://fedoraproject.org/wiki/Changes/FlexiBLAS_as_BLAS/LAPACK_manager - -* Tue Jul 28 2020 Fedora Release Engineering - 2.3.1-47 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_33_Mass_Rebuild - -* Mon Jul 27 2020 Jeff Law - 2.3.1-46 -- Use C++14 as this code is not C++17 ready - -* Wed Jan 29 2020 Fedora Release Engineering - 2.3.1-45 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_32_Mass_Rebuild - -* Thu Jul 25 2019 Fedora Release Engineering - 2.3.1-44 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_31_Mass_Rebuild - -* Fri Feb 01 2019 Fedora Release Engineering - 2.3.1-43 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_30_Mass_Rebuild - -* Fri Jul 13 2018 Fedora Release Engineering - 2.3.1-42 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_29_Mass_Rebuild - -* Thu Feb 08 2018 Fedora Release Engineering - 2.3.1-41 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_28_Mass_Rebuild - -* Wed Jan 31 2018 Mamoru TASAKA - 2.3.1-40 -- F-28: rebuild against gfortran 8 - -* Thu Aug 03 2017 Fedora Release Engineering - 2.3.1-39 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_27_Binutils_Mass_Rebuild - -* Wed Jul 26 2017 Fedora Release Engineering - 2.3.1-38 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_27_Mass_Rebuild - -* Mon May 15 2017 Fedora Release Engineering - 2.3.1-37 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_26_27_Mass_Rebuild - -* Fri Feb 10 2017 Fedora Release Engineering - 2.3.1-36 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_26_Mass_Rebuild - -* Mon Jan 30 2017 Mamoru TASAKA - 2.3.1-35 -- F-26: rebuild against gfortran 7 - -* Fri May 6 2016 Mamoru TASAKA - 2.3.1-34 -- Fix up sc-config all_sclibs -- Rename arch-dependent scripts into arch-dependent names -- Kill -doc dependency from -data - -* Sun Apr 24 2016 Mamoru TASAKA - 2.3.1-33 -- C++11 build fix by using constexpr - -* Thu Feb 04 2016 Fedora Release Engineering - 2.3.1-32 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_24_Mass_Rebuild - -* Wed Jun 17 2015 Fedora Release Engineering - 2.3.1-31 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_23_Mass_Rebuild - -* Sat May 02 2015 Kalev Lember - 2.3.1-30 -- Rebuilt for GCC 5 C++11 ABI change - -* Thu Sep 11 2014 Susi Lehtola - 2.3.1-29 -- Libint require needs to be in -libs, not main package. - -* Thu Sep 11 2014 Susi Lehtola - 2.3.1-28.1 -- Forgot to do buildroot override. - -* Tue Sep 09 2014 Susi Lehtola - 2.3.1-28 -- Requires: libint(api). - -* Sun Aug 17 2014 Fedora Release Engineering - 2.3.1-27 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_21_22_Mass_Rebuild - -* Tue Jun 17 2014 Yaakov Selkowitz - 2.3.1-26 -- Fix FTBFS with -Werror=format-security (#1106244) -- Update to recent packaging guidelines - -* Sat Jun 07 2014 Fedora Release Engineering - 2.3.1-25 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_21_Mass_Rebuild - -* Mon Dec 23 2013 Susi Lehtola - 2.3.1-24 -- Fix build against new atlas. -- Rebuild against libint. - -* Sat Aug 03 2013 Fedora Release Engineering - 2.3.1-23 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_20_Mass_Rebuild - -* Wed Jul 17 2013 Petr Pisar - 2.3.1-22 -- Perl 5.18 rebuild - -* Fri Mar 29 2013 Carl Byington 2.3.1-21 -- add autoreconf for aarch64 - -* Thu Feb 14 2013 Fedora Release Engineering - 2.3.1-20 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_19_Mass_Rebuild - -* Wed Jul 25 2012 Jussi Lehtola - 2.3.1-19 -- Rebuild due to changed libint. - -* Fri Jul 20 2012 Fedora Release Engineering - 2.3.1-18 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_18_Mass_Rebuild - -* Tue Feb 28 2012 Fedora Release Engineering - 2.3.1-17 -- Rebuilt for c++ ABI breakage - -* Fri Jan 13 2012 Fedora Release Engineering - 2.3.1-16 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_17_Mass_Rebuild - -* Wed Feb 09 2011 Fedora Release Engineering - 2.3.1-15 -- Rebuilt for https://fedoraproject.org/wiki/Fedora_15_Mass_Rebuild - * Wed Dec 08 2010 Carl Byington 2.3.1-14 - rebuild for libint changes diff --git a/sources b/sources index d010396..a687b30 100644 --- a/sources +++ b/sources @@ -1 +1,2 @@ +5d74696a11ee9231e8b9078803ffad7e mpqc-2.3.1-mdv-fix-wfn-lib.patch 2f9b4f7487387730d78066a53764f848 mpqc-2.3.1.tar.bz2