diff options
author | V3n3RiX <venerix@koprulu.sector> | 2024-10-19 04:04:36 +0100 |
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committer | V3n3RiX <venerix@koprulu.sector> | 2024-10-19 04:04:36 +0100 |
commit | d895362f98ae63a6ed12cd16d3b3df95d6967f25 (patch) | |
tree | e6c8a50e31dc122b10c6dc3d9eee5d6ec6f002c0 /sci-chemistry/mopac7 | |
parent | 483d7c056fba15727fe24545f93627a1d1e1e2eb (diff) |
gentoo auto-resync : 19:10:2024 - 04:04:35
Diffstat (limited to 'sci-chemistry/mopac7')
-rw-r--r-- | sci-chemistry/mopac7/Manifest | 6 | ||||
-rw-r--r-- | sci-chemistry/mopac7/files/Makefile | 18 | ||||
-rw-r--r-- | sci-chemistry/mopac7/metadata.xml | 14 | ||||
-rw-r--r-- | sci-chemistry/mopac7/mopac7-1.15-r1.ebuild | 78 |
4 files changed, 0 insertions, 116 deletions
diff --git a/sci-chemistry/mopac7/Manifest b/sci-chemistry/mopac7/Manifest deleted file mode 100644 index 25d061c91462..000000000000 --- a/sci-chemistry/mopac7/Manifest +++ /dev/null @@ -1,6 +0,0 @@ -AUX Makefile 387 BLAKE2B b0c4b3a009c8bf8c779953edf3e233434656033a661cb307079eebc980a827215fcd0dc04cf1df245ec20a6f95c151e4f9a9816c56cf8d6c1da6f77214fb41a5 SHA512 5bde85940d1d850ae65d23802aefb57660fda512d452660fdc37a19ae1f50c7f1240bfeffdd81a52cbd0a3140dad76272ca60333b60d40d1d79fdfe7297857dd -DIST dcart.f 11044 BLAKE2B 7414804ecfab9a7cbddee664b85e6e2e8c1d8fe1e1f73d480dd1a387c5e349d26ec4ae1a37f27e38b7c051fcce2c1bdf77de12ec628298fd3edf79040a8a0c5a SHA512 788a184fd8419ff742e49c1a652d5ea093f9114dbe4f272665b8fb9eeac2afb7f7042628c288f2b81d0f54d8a7ef2f400490cd3aff39dda59a6d70a0deab5b80 -DIST gmxmop.f 38956 BLAKE2B e411feca5104e91ae8fd2008de61d18cc214beb3b2a7aa09a80269fb935e27ba1b1cb89fa30eedbfc4f6c4734c22d932e57d5905c175ae9f56c4affee7b0ca04 SHA512 38bb2e5749c4d3c8c24f15682f72e40cb4edb6517c7916cecee1d21675b1870c0fe331ba2ec40312408dec473141e7742d1e155d4b64f1c2a25bfa4e11885194 -DIST mopac7-1.15.tar.gz 764547 BLAKE2B 6e037862007221955d0ad65f3c002a3d2e461950a2bc0efac9d195cf1d9d856842d02bc380ce236c3d48f863a144875950f5c86f8f3ac936b8b098472f7f7a0d SHA512 e0ccd643caa6dbd7e156867530d79e50e10243f5e3b5f8bc57781e68e1daf26f2a0e6987fff00afe07eb0fcb98cbd9f01e4cfa5d20acc0d8ab3cca632968636e -EBUILD mopac7-1.15-r1.ebuild 1979 BLAKE2B 9ed2f685e1b787f1eece439ca75efe489601651712aa6dbab8fff05d78e0ce3d97a5116266568d985e2ca67749e4bd39dd606f8f419141ce39ccadf39de9fe22 SHA512 add91d8a0b7da52ecebed3f611fb259110ab4872554ea2db94bb476625ef2c09ea83220f6e16f69303c6bba368bbd1681ec293f013cfce05a05b6a3271438d0a -MISC metadata.xml 435 BLAKE2B 12efd7ecfe6c9b07411d62992a225848f3787b58a59765e373fdc98ce22c3b50763243ac70efa1d7a7ec3309bc519dd433d41b778fe8f18cdfbdae971e0ee82c SHA512 d624b1181bdd0d66062507e7793eb25d24c447fa9ffbe8ee1645c88b843e6822e80af087bf6073ac191947074491159331f2021b884f8b7cd2237cf3e013ebb4 diff --git a/sci-chemistry/mopac7/files/Makefile b/sci-chemistry/mopac7/files/Makefile deleted file mode 100644 index bcada8b0a889..000000000000 --- a/sci-chemistry/mopac7/files/Makefile +++ /dev/null @@ -1,18 +0,0 @@ -VERSION = GENTOOVERSION -MAJOR = 1 - -LIBS = -lgfortran -lf2c - -objects := $(patsubst %.f,%.o,$(wildcard *.f)) - -all: libgmxmopac7 - -clean: - rm -f moldat.*f deriv.* mopac7*.* compfg.* dcart.* - -%.o: %.f - $(FC) $(FFLAGS) -fPIC -c $< - -libgmxmopac7: $(objects) - $(FC) -shared $(LDFLAGS) -Wl,-soname,libgmxmopac7.so.$(MAJOR) -o $@.so.$(VERSION) $^ $(LIBS) - ln -sf $@.so.$(VERSION) libgmxmopac7.so diff --git a/sci-chemistry/mopac7/metadata.xml b/sci-chemistry/mopac7/metadata.xml deleted file mode 100644 index cd1cacd0abf9..000000000000 --- a/sci-chemistry/mopac7/metadata.xml +++ /dev/null @@ -1,14 +0,0 @@ -<?xml version="1.0" encoding="UTF-8"?> -<!DOCTYPE pkgmetadata SYSTEM "https://www.gentoo.org/dtd/metadata.dtd"> -<pkgmetadata> - <maintainer type="project"> - <email>sci-chemistry@gentoo.org</email> - <name>Gentoo Chemistry Project</name> - </maintainer> - <use> - <flag name="gmxmopac7">Add support library for gromacs</flag> - </use> - <upstream> - <remote-id type="sourceforge">mopac7</remote-id> - </upstream> -</pkgmetadata> diff --git a/sci-chemistry/mopac7/mopac7-1.15-r1.ebuild b/sci-chemistry/mopac7/mopac7-1.15-r1.ebuild deleted file mode 100644 index c536575112e8..000000000000 --- a/sci-chemistry/mopac7/mopac7-1.15-r1.ebuild +++ /dev/null @@ -1,78 +0,0 @@ -# Copyright 1999-2024 Gentoo Authors -# Distributed under the terms of the GNU General Public License v2 - -EAPI=8 - -inherit autotools fortran-2 flag-o-matic toolchain-funcs - -DESCRIPTION="Autotooled, updated version of a powerful, fast semi-empirical package" -HOMEPAGE="https://sourceforge.net/projects/mopac7/" -SRC_URI=" - http://www.bioinformatics.org/ghemical/download/current/${P}.tar.gz - http://wwwuser.gwdg.de/~ggroenh/qmmm/mopac/dcart.f - http://wwwuser.gwdg.de/~ggroenh/qmmm/mopac/gmxmop.f" - -LICENSE="public-domain" -SLOT="0" -KEYWORDS="amd64 ~ppc ~x86 ~amd64-linux" -IUSE="gmxmopac7" - -DEPEND="dev-libs/libf2c" -RDEPEND="${DEPEND}" - -src_prepare() { - default - - # Install the executable - sed -i \ - -e "s:noinst_PROGRAMS = mopac7:bin_PROGRAMS = mopac7:g" \ - fortran/Makefile.am \ - || die "sed failed: install mopac7" - # Install the script to run the executable - sed -i \ - -e "s:EXTRA_DIST = autogen.sh run_mopac7:bin_SCRIPTS = run_mopac7:g" \ - Makefile.am \ - || die "sed failed: install run_mopac7" - - eautoreconf - append-fflags -std=legacy -fno-automatic -} - -src_configure() { - # -Werror=lto-type-mismatch - # https://bugs.gentoo.org/927389 - # - # Unmaintained fortran code, no bug report. - filter-lto - - econf --disable-static -} - -src_compile() { - emake - if use gmxmopac7; then - einfo "Making mopac7 lib for gromacs" - mkdir "${S}"/fortran/libgmxmopac7 || die - cd "${S}"/fortran/libgmxmopac7 || die - cp -n ../SIZES ../*.f "${FILESDIR}"/Makefile . || die - emake clean - cp -n "${DISTDIR}"/gmxmop.f "${DISTDIR}"/dcart.f . || die - sed "s:GENTOOVERSION:${PV}:g" -i Makefile || die - emake FC="$(tc-getFC)" - fi -} - -src_install() { - # A correct fix would have a run_mopac7.in with @bindir@ that gets - # replaced by configure, and run_mopac7 added to AC_OUTPUT in configure.ac - sed -i "s:./fortran/mopac7:mopac7:g" run_mopac7 || die - - default - - if use gmxmopac7; then - cd "${S}"/fortran/libgmxmopac7 || die - dolib.so libgmxmopac7.so* - fi - - find "${ED}" -name '*.la' -delete || die -} |