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authorPacho Ramos <pacho@gentoo.org>2021-05-02 21:22:03 +0200
committerPacho Ramos <pacho@gentoo.org>2021-05-02 21:22:23 +0200
commit8c9499c1d811547d4d69f60d5b78ae7edacdd922 (patch)
treee5208d22e3202acef813f7021ad5326959fb012d /sci-chemistry
parentsci-chemistry/pymol: Re-host distfiles (diff)
downloadgentoo-8c9499c1d811547d4d69f60d5b78ae7edacdd922.tar.gz
gentoo-8c9499c1d811547d4d69f60d5b78ae7edacdd922.tar.bz2
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sci-chemistry/vmd: Drop old
Package-Manager: Portage-3.0.18, Repoman-3.0.3 Signed-off-by: Pacho Ramos <pacho@gentoo.org>
Diffstat (limited to 'sci-chemistry')
-rw-r--r--sci-chemistry/vmd/Manifest3
-rw-r--r--sci-chemistry/vmd/files/vmd-1.9.4-gentoo-paths.patch276
-rw-r--r--sci-chemistry/vmd/files/vmd-1.9.4-tmpdir.patch11
-rw-r--r--sci-chemistry/vmd/vmd-1.9.4_alpha43.ebuild277
4 files changed, 0 insertions, 567 deletions
diff --git a/sci-chemistry/vmd/Manifest b/sci-chemistry/vmd/Manifest
index a94593a65fc2..dbb4249c9283 100644
--- a/sci-chemistry/vmd/Manifest
+++ b/sci-chemistry/vmd/Manifest
@@ -1,5 +1,2 @@
-DIST vmd-1.9.3-gentoo-patches.tar.xz 14804 BLAKE2B 64e5df40ed88c23c924d32636495f0383590f91dbb714e64c73551072bb50d72b4e5f188fb2da58d32e84b4bc96ff0297d7ff1bf02b0481198901c4e12e4ee59 SHA512 5d506d4df5ca4a3edb33d77aeeb440fcb4750a250c77103b99f385f356eb9d71d954173b981d3a50f7a714cfc872587e5040868904e50fa1f6fd69d7e4d9f1b1
-DIST vmd-1.9.4-gentoo-plugins.patch 24618 BLAKE2B 6fbcf2e3bb59765e0980a5ed46f02e29d7b72a313865849c15891f2398d2aaf9afe6069f993a61257572d031556ce523c622858e29611ca6795be6030f4bb186 SHA512 9b8675811992d6392e9ec49cdcbcfd0da99dce1e164be4f8bf9bd07e0582b6b1e1d25f3e90fbc91cad7f94984bd091e644713c136628d0e4cc60e782a855fb63
DIST vmd-1.9.4_alpha51-gentoo-patches.tar.xz 14604 BLAKE2B f8621956785d365cc056ba53373120d8f99da1476ab9789af6bb8ef00b8dd8c2a4c3599d75e13eba2fc5630b291aed966ce64f7f408504b079e3e994e45da243 SHA512 c57fd81e667e405ab1208a4e4a1d63710e593c07f554420c32980becd3547c2df98fbf6e439a53a626121fc361559f1ba53ab7b7235c97422bba61ece59d23bc
-DIST vmd-1.9.4a43.src.tar 123955200 BLAKE2B a99ee2bce1024613ad951fc97f4cd4b6f6ad114aea67a0a6644f687c69eae488eb862fd5ea5bff31e12f01a95f6f60be04dad2a82879603b9b457443267bb18f SHA512 3e3d5d7b0d220f070d4978940ff5ab8af531e507a224cdd15e4871e263de64b4ba24e9d964cb680b31f376afbdc08f46cb4070e3cd4a474b9bfe0732c7b3cff0
DIST vmd-1.9.4a51.src.tar.gz 42826371 BLAKE2B 239d87f975c41a71096083028c1db8bf40cc058fc687fd9fff3c14c97c9b12bd68818d4c2eaeefd8c95c661409f1f056bce42178d0ba9271aa344fdce6f81ea9 SHA512 b42af6a4a7b1d2f0d242f89bff3a1c25a608ff59b9902b90154ba82a40439afb802a2d319363fa388a5211420fdaf0ee9bfd1f0a0e6e85d89d1dd506b373ba40
diff --git a/sci-chemistry/vmd/files/vmd-1.9.4-gentoo-paths.patch b/sci-chemistry/vmd/files/vmd-1.9.4-gentoo-paths.patch
deleted file mode 100644
index ca74b868d8f4..000000000000
--- a/sci-chemistry/vmd/files/vmd-1.9.4-gentoo-paths.patch
+++ /dev/null
@@ -1,276 +0,0 @@
---- a/bin/vmd.sh.old 2020-09-09 18:02:09.135798193 +0200
-+++ b/bin/vmd.sh 2020-09-09 18:37:22.355511675 +0200
-@@ -436,6 +436,7 @@
-
- # set the path to a few external programs
- # Stride -- used to generate cartoon representations etc.
-+export STRIDE_BIN="gentoo-stride"
- if [ -z "$STRIDE_BIN" ]
- then
- if [ -x "$MASTERVMDDIR/stride_$ARCH" ]
-@@ -446,6 +447,7 @@
- fi
-
- # Surf -- used to generate molecular surfaces
-+export SURF_BIN="gentoo-surf"
- if [ -z "$SURF_BIN" ]
- then
- if [ -x "$MASTERVMDDIR/surf_$ARCH" ]
-@@ -456,6 +458,7 @@
- fi
-
- # Tachyon -- used to generate ray traced graphics
-+export TACHYON_BIN="gentoo-tachyon"
- if [ -z "$TACHYON_BIN" ]
- then
- if [ -x "$MASTERVMDDIR/tachyon_$ARCH" ]
---- a/configure.old 2020-09-09 18:05:55.778655084 +0200
-+++ b/configure 2020-09-09 18:38:01.607083112 +0200
-@@ -13,11 +13,10 @@
- $install_name = "vmd";
-
- # Directory where VMD startup script is installed, should be in users' paths.
--$install_bin_dir="/usr/local/bin";
-+$install_bin_dir="gentoo-bindir";
-
- # Directory where VMD files and executables are installed
--$install_library_dir="/usr/local/lib/$install_name";
--
-+$install_library_dir="gentoo-libdir/$install_name";
-
- # optionally override hard-coded defaults above with environment variables
- if ($ENV{VMDINSTALLNAME}) {
-@@ -143,29 +142,6 @@
- # Configure script code begins here
- ############################################################################
-
--## Test for existence of a properly compiled plugin tree
--if (!(-e "plugins")) {
-- print "\n";
-- print "VMD plugin directory not found.\n";
-- print "Please compile the VMD plugins and do 'make distrib' to copy them\n";
-- print "into a 'plugins' directory linked or located in this directory.\n";
-- print "Be sure your PLUGINDIR environment variable is set before running\n";
-- print "'make distrib' in the plugin build area.\n";
-- print "\n";
-- die "Halting configuration until VMD plugins are built.\n";
--} else {
-- if (!(-e "plugins/include/vmdplugin.h")) {
-- print "\n";
-- print "VMD plugin include files or directory not found.\n";
-- print "Please compile the VMD plugins and do 'make distrib' to copy them\n";
-- print "into a 'plugins' directory linked or located in this directory.\n";
-- print "Be sure your PLUGINDIR environment variable is set before running\n";
-- print "'make distrib' in the plugin build area.\n";
-- print "\n";
-- die "Halting configuration until VMD plugins are built.\n";
-- }
--}
--
- #################### Parse command line options ###########
- # list of allowed architectures
- @archlist=('AIX6_64', 'ANDROIDARMV7A', 'BLUEGENEQ', 'BLUEWATERS', 'CRAY_XC', 'CRAY_XK', 'FREEBSD', 'FREEBSDAMD64', 'LINUX', 'LINUXAMD64', 'LINUXARM64', 'LINUXCARMA', 'LINUXPPC64', 'MACOSX', 'MACOSXX86', 'MACOSXX86_64', 'OPENPOWER', 'SUMMIT', 'SUMMITDEV', 'SOLARIS2', 'SOLARIS2_64', 'SOLARISX86', 'SOLARISX86_64', 'WIN32', 'WIN64');
-@@ -493,7 +469,7 @@
-
- $arch_cc = "cc";
- $arch_ccpp = "CC";
--$arch_nvcc = "/usr/local/cuda-10.2/bin/nvcc";
-+$arch_nvcc = "gentoo-nvcc";
- $arch_nvccflags = "-lineinfo --ptxas-options=-v " .
- "-gencode arch=compute_30,code=compute_30 " .
- "-gencode arch=compute_30,code=sm_35 " .
-@@ -537,7 +513,7 @@
-
- ################ Plugin options
- #
--$plugin_dir = "../plugins";
-+$plugin_dir = "gentoo-plugindir";
- $plugin_include = "-I$plugin_dir/include";
- $plugin_library = "";
- $plugin_libs = "";
-@@ -550,7 +526,7 @@
- @plugin_extra = ();
-
- if ($config_staticplugin) {
-- $molfile_dir = "$plugin_dir/$config_arch/molfile";
-+ $molfile_dir = "$plugin_dir/compile/lib_LINUX/molfile";
- $plugin_include .= " -I$molfile_dir";
- $plugin_library .= " -L$molfile_dir";
- $plugin_libs .= " -lmolfile_plugin";
-@@ -715,8 +691,8 @@
- ################ FLTK GUI
- $fltk_defines = "-DVMDGUI -DVMDFLTK";
- $fltk_dir = "$vmd_library_dir/fltk";
--$fltk_include = "-I$fltk_dir/include";
--$fltk_library = "-L$fltk_dir/$config_arch";
-+$fltk_include = "-Igentoo-fltk-include";
-+$fltk_library = "-Lgentoo-fltk-libs";
- $fltk_libs = "-lfltk -lX11";
- #@fltk_cc = ('forms_ui.c');
- @fltk_cu = ();
-@@ -777,8 +753,8 @@
- if ($config_tk) { $tcl_include .= " -I$stock_tk_include_dir"; }
- $tcl_library = "-L$stock_tcl_library_dir";
- if ($config_tk) { $tcl_library .= " -L$stock_tk_library_dir"; }
--$tcl_libs = "-ltcl8.5";
--if ($config_tk) { $tcl_libs = "-ltk8.5 -lX11 " . $tcl_libs; }
-+$tcl_libs = "-ltcl";
-+if ($config_tk) { $tcl_libs = "-ltk -lX11 " . $tcl_libs; }
-
- @tcl_cc = ();
- @tcl_cu = ();
-@@ -1289,8 +1265,8 @@
- # This may be commented out if not required.
- $libtachyon_defines = "-DVMDLIBTACHYON";
- $libtachyon_dir = "$vmd_library_dir/tachyon";
--$libtachyon_include = "-I$libtachyon_dir/include";
--$libtachyon_library = "-L$libtachyon_dir/lib_$config_arch";
-+$libtachyon_include = "-Igentoo-libtachyon-include";
-+$libtachyon_library = "-Lgentoo-libtachyon-libs";
- $libtachyon_libs = "-ltachyon";
- @libtachyon_cc = ();
- @libtachyon_cu = ();
-@@ -1541,8 +1517,8 @@
- #######################
- $netcdf_defines = "";
- $netcdf_dir = "$vmd_library_dir/netcdf";
--$netcdf_include = "-I$netcdf_dir/include";
--$netcdf_library = "-L$netcdf_dir/lib_$config_arch";
-+$netcdf_include = "-Igentoo-netcdf-include";
-+$netcdf_library = "-Lgentoo-netcdf-libs";
- $netcdf_libs = "-lnetcdf";
- @netcdf_cc = ();
- @netcdf_cu = ();
-@@ -1595,6 +1571,7 @@
- #$stock_python_library_dir=$ENV{"PYTHON_LIBRARY_DIR"} || "/usr/local/lib";
- $stock_python_include_dir=$ENV{"PYTHON_INCLUDE_DIR"} || "$vmd_library_dir/python/lib_$config_arch/include/python2.5";
- $stock_python_library_dir=$ENV{"PYTHON_LIBRARY_DIR"} || "$vmd_library_dir/python/lib_$config_arch/lib/python2.5/config";
-+$stock_python_library=$ENV{"PYTHON_LIBRARY"} || "$vmd_library_dir/python/lib_$config_arch/lib/python2.5/config";
-
- #$stock_numpy_include_dir=$ENV{"NUMPY_INCLUDE_DIR"} || "/usr/local/include";
- #$stock_numpy_library_dir=$ENV{"NUMPY_LIBRARY_DIR"} || "/usr/local/lib";
-@@ -1604,7 +1581,7 @@
- $python_defines = "-DVMDPYTHON";
- $python_include = "-I$stock_python_include_dir -I$stock_numpy_include_dir -I$stock_numpy_library_dir";
- $python_library = "-L$stock_python_library_dir";
--$python_libs = "-lpython2.5 -lpthread";
-+$python_libs = "$stock_python_library -lpthread";
- @python_h = ('PythonTextInterp.h',
- 'VMDTkinterMenu.h',
- 'py_commands.h',
-@@ -2350,8 +2327,8 @@
-
- # XFree 4.0 Direct Rendering Interface and GLX
- $opengl_dep_dir = "/usr/X11R6";
-- $opengl_dep_include = "-I$opengl_dep_dir/include";
-- $opengl_dep_library = "-L$opengl_dep_dir/lib";
-+ $opengl_dep_include = "-Igentoo-opengl-include";
-+ $opengl_dep_library = "-Lgentoo-opengl-libs";
- $opengl_dep_libs = "-lGL";
- # $opengl_dep_libs = "-L/usr/X11R6/lib -lGL -lXext -lX11";
-
-@@ -2381,15 +2358,15 @@
- $arch_lopts .= "-i-static ";
- } else {
- # compling with GCC
-- $arch_cc = "gcc";
-- $arch_ccpp = "g++";
-+ $arch_cc = "gentoo-gcc";
-+ $arch_ccpp = "gentoo-g++";
- $arch_depend_flag = "-MM";
-- $arch_shld = "g++ -shared";
-+ $arch_shld = "gentoo-g++ -shared";
- $arch_shlibname = "so";
- $arch_shcppopts = "-fPIC";
-- $arch_shldopts = "";
-- $arch_opt_flag = "-m32 -fno-for-scope -Wno-deprecated -Wall -Wno-unknown-pragmas -O3";
-- $arch_copts = "-m32 -Wall -Wno-unknown-pragmas -O3";
-+ $arch_shldopts = "gentoo-ldflags";
-+ $arch_opt_flag = "gentoo-cflags";
-+ $arch_copts = "gentoo-cflags";
-
- if ($config_static) {
- $arch_lopts = "-static";
-@@ -2407,14 +2384,13 @@
-
- $arch_cppopts = "";
- if ($config_cuda) {
-- $arch_nvcc = "/usr/local/cuda-4.0/bin/nvcc";
- $arch_nvccflags = "--ptxas-options=-v " .
- "-gencode arch=compute_13,code=sm_13 " .
- "-gencode arch=compute_20,code=sm_20 " .
- "-gencode arch=compute_20,code=compute_20 " .
- "--ftz=true ";
-- $arch_nvccflags .= " --machine 32 -O3 -Xcompiler \"-m32\" $cuda_include";
-- $cuda_library = "-L/usr/local/cuda-4.0/lib";
-+ $arch_nvccflags .= "gentoo-nvflags $cuda_include";
-+ $cuda_library = "-Lgentoo-cuda-lib";
- $cuda_libs = "-Wl,-rpath -Wl,\$\$ORIGIN/ -lcudart";
- }
- # this is to make tcl happy
-@@ -2513,7 +2489,7 @@
-
- if ($config_cuda) {
- $arch_nvccflags .= " --machine 64 -O3 $cuda_include";
-- $cuda_library = "-L/usr/local/cuda-10.2/lib64";
-+ $cuda_library = "-Lgentoo-cuda-lib";
- }
-
- $arch_lex = "flex"; # has problems with vendor lex
-@@ -3502,11 +3478,11 @@
- DEFINES = $DEFINES
-
- # compiler and compiler directives
--CC = $arch_cc
--CFLAGS = $arch_copts -DARCH_$config_arch \$(DEFINES) \$(INCDIRS) $rpm_optflags
-+CC = gentoo-gcc
-+CFLAGS = gentoo-cflags -DARCH_$config_arch \$(DEFINES) \$(INCDIRS) $rpm_optflags
-
--CCPP = $arch_ccpp
--CPPFLAGS = $arch_opt_flag $arch_cppopts -DARCH_$config_arch \$(DEFINES) \$(INCDIRS) $rpm_optflags
-+CCPP = gentoo-g++
-+CPPFLAGS = gentoo-cxxflags $arch_cppopts -DARCH_$config_arch \$(DEFINES) \$(INCDIRS) $rpm_optflags
-
- NVCC = $arch_nvcc
- NVCCFLAGS = $arch_nvccflags -DARCH_$config_arch \$(DEFINES) \$(INCDIRS)
-@@ -3555,7 +3531,7 @@
- $config_progname: y.tab.h \$(VMD_OBJS) \$(VMD_PTX)
- \$(ECHO) "Linking " \$\@ "..."; \\
- \$(CD) $vmd_arch_dir ; \\
-- \$(CCPP) \$(CPPFLAGS) -I$vmd_src_dir -o \$\@ \$(VMD_OBJS) \$(LOADLIBES) ;
-+ \$(CCPP) \$(LDFLAGS) \$(CPPFLAGS) -I$vmd_src_dir -o \$\@ \$(VMD_OBJS) \$(LOADLIBES) ;
- \$(COMPILERC) \$(RCFLAGS)
-
- install:
-@@ -3596,8 +3572,7 @@
- -\$(COPY) ../data/.vmdrc ../data/.vmdsensors ../data/vmd_completion.dat "$install_library_dir"
- \$(CD) $vmd_bin_dir ; \\
- if [ -f run_vmd_tmp ]; then \$(DELETE) run_vmd_tmp; fi ; \\
-- if [ ! -x "/bin/csh" ]; then \\
-- \$(ECHO) "Info: /bin/csh shell not found, installing Bourne shell startup script instead" ; \\
-+ if [ -x "/bin/bash" ]; then \\
- \$(ECHO) '#!/bin/sh' >> run_vmd_tmp ; \\
- \$(ECHO) 'defaultvmddir="$install_library_dir"' >> run_vmd_tmp ; \\
- \$(ECHO) 'vmdbasename=vmd' >> run_vmd_tmp ; \\
---- a/src/Makefile.old 2020-09-09 18:22:46.234818925 +0200
-+++ b/src/Makefile 2020-09-09 18:37:22.356511690 +0200
-@@ -647,7 +647,7 @@
- vmd_LINUXAMD64: y.tab.h $(VMD_OBJS) $(VMD_PTX)
- $(ECHO) "Linking " $@ "..."; \
- $(CD) ../LINUXAMD64 ; \
-- $(CCPP) $(CPPFLAGS) -I../src -o $@ $(VMD_OBJS) $(LOADLIBES) ;
-+ $(CCPP) $(LDFLAGS) $(CPPFLAGS) -I../src -o $@ $(VMD_OBJS) $(LOADLIBES) ;
- $(COMPILERC) $(RCFLAGS)
-
- install:
-@@ -660,10 +660,6 @@
- if [ ! -d "/usr/local/lib/vmd"/doc ]; then \
- $(MAKEDIR) "/usr/local/lib/vmd"/doc; \
- fi
-- -$(COPY) ../Announcement "/usr/local/lib/vmd"
-- -$(COPY) ../README "/usr/local/lib/vmd"
-- -$(COPY) ../LICENSE "/usr/local/lib/vmd"
-- -$(COPY) ../doc/ug.pdf "/usr/local/lib/vmd"/doc
- if [ -f /usr/local/lib/vmd/vmd_LINUXAMD64 ]; then \
- $(MOVE) "/usr/local/lib/vmd/vmd_LINUXAMD64" "/usr/local/lib/vmd/OLD_vmd_LINUXAMD64" ; $(DELETE) "/usr/local/lib/vmd/OLD_vmd_LINUXAMD64" ; fi
- -$(COPY) ../LINUXAMD64/vmd_LINUXAMD64 "/usr/local/lib/vmd"
diff --git a/sci-chemistry/vmd/files/vmd-1.9.4-tmpdir.patch b/sci-chemistry/vmd/files/vmd-1.9.4-tmpdir.patch
deleted file mode 100644
index 295811db0580..000000000000
--- a/sci-chemistry/vmd/files/vmd-1.9.4-tmpdir.patch
+++ /dev/null
@@ -1,11 +0,0 @@
---- a/scripts/vmd/chemical2vmd.old 2020-09-09 18:40:56.795215443 +0200
-+++ b/scripts/vmd/chemical2vmd 2020-09-09 18:41:09.648348701 +0200
-@@ -61,7 +61,7 @@
-
-
- # Make a temp. file to store the load command
--$ENV{'TMPDIR'} = '/usr/tmp' if !$ENV{'TMPDIR'};
-+$ENV{'TMPDIR'} = '/tmp' if !$ENV{'TMPDIR'};
- sub tmpfile {
- local ($tempfile) = $ENV{'TMPDIR'} . '/chemical2vmd.' . $$;
- local ($i);
diff --git a/sci-chemistry/vmd/vmd-1.9.4_alpha43.ebuild b/sci-chemistry/vmd/vmd-1.9.4_alpha43.ebuild
deleted file mode 100644
index 417828a3209f..000000000000
--- a/sci-chemistry/vmd/vmd-1.9.4_alpha43.ebuild
+++ /dev/null
@@ -1,277 +0,0 @@
-# Copyright 1999-2020 Gentoo Authors
-# Distributed under the terms of the GNU General Public License v2
-
-EAPI=7
-PYTHON_COMPAT=( python3_{7..9} )
-
-inherit cuda desktop flag-o-matic prefix python-single-r1 toolchain-funcs xdg
-
-DESCRIPTION="Visual Molecular Dynamics"
-HOMEPAGE="http://www.ks.uiuc.edu/Research/vmd/"
-
-MY_PV="${PV/_alpha/a}"
-MY_P="${PN}-${MY_PV}"
-SRC_URI="
- ${MY_P}.src.tar
- https://dev.gentoo.org/~jlec/distfiles/${PN}-1.9.3-gentoo-patches.tar.xz
- https://dev.gentoo.org/~juippis/distfiles/tmp/vmd-1.9.4-gentoo-plugins.patch
-"
-
-SLOT="0"
-LICENSE="vmd"
-KEYWORDS="~amd64 ~x86 ~amd64-linux ~x86-linux"
-
-IUSE="cuda gromacs msms povray sqlite tachyon xinerama"
-REQUIRED_USE="${PYTHON_REQUIRED_USE}"
-
-RESTRICT="fetch"
-
-CDEPEND="
- >=dev-lang/tk-8.6.1:0=
- dev-lang/perl
- dev-libs/expat
- $(python_gen_cond_dep 'dev-python/numpy[${PYTHON_MULTI_USEDEP}]')
- sci-libs/netcdf:0=
- virtual/opengl
- >=x11-libs/fltk-1.1.10-r2:1
- x11-libs/libXft
- x11-libs/libXi
- ${PYTHON_DEPS}
- cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1:= )
- gromacs? ( >=sci-chemistry/gromacs-5.0.4-r1:0=[tng] )
- sqlite? ( dev-db/sqlite:3= )
- tachyon? ( >=media-gfx/tachyon-0.99_beta6 )
- xinerama? ( x11-libs/libXinerama )
-"
-DEPEND="${CDEPEND}"
-BDEPEND="
- virtual/pkgconfig
- dev-lang/swig
-"
-RDEPEND="${CDEPEND}
- sci-biology/stride
- sci-chemistry/chemical-mime-data
- sci-chemistry/surf
- x11-terms/xterm
- msms? ( sci-chemistry/msms-bin )
- povray? ( media-gfx/povray )
-"
-
-S="${WORKDIR}/${MY_P}"
-
-VMD_DOWNLOAD="http://www.ks.uiuc.edu/Development/Download/download.cgi?PackageName=VMD"
-# Binary only plugin!!
-QA_PREBUILT="usr/lib*/vmd/plugins/LINUX/tcl/intersurf/bin/intersurf.so"
-QA_FLAGS_IGNORED_amd64=" usr/lib64/vmd/plugins/LINUX/tcl/volutil/volutil"
-QA_FLAGS_IGNORED_x86=" usr/lib/vmd/plugins/LINUX/tcl/volutil/volutil"
-
-pkg_nofetch() {
- elog "Please download ${MY_P}.src.tar from"
- elog "${VMD_DOWNLOAD}"
- elog "after agreeing to the license and get"
- elog "https://dev.gentoo.org/~jlec/distfiles/${PN}-1.9.3-gentoo-patches.tar.xz"
- elog "https://dev.gentoo.org/~juippis/distfiles/tmp/vmd-1.9.4-gentoo-plugins.patch"
- elog "Place them into your DISTDIR directory"
- elog
- elog "Due to an upstream bug (https://bugs.gentoo.org/640440) sources"
- elog "file may get downloaded as a compressed tarball or not. In that case"
- elog "you will need to ensure you uncompress the file and rename it"
- elog "to ${MY_P}.src.tar"
-}
-
-src_prepare() {
- # Apply user patches from ${WORKDIR} to allow patching on patches
- # subdir too
- cd "${WORKDIR}"
- xdg_src_prepare
-
- # https://www.ks.uiuc.edu/Research/vmd/mailing_list/vmd-l/32121.html
- # https://www.ks.uiuc.edu/Research/vmd/mailing_list/vmd-l/32116.html
- eapply "${DISTDIR}"/${PN}-1.9.4-gentoo-plugins.patch
-
- use cuda && cuda_sanitize
-
- # Prepare plugins
- cd plugins || die
-
- sed '/^.SILENT/d' -i $(find -name Makefile)
-
- sed \
- -e "s:CC = gcc:CC = $(tc-getCC):" \
- -e "s:CXX = g++:CXX = $(tc-getCXX):" \
- -e "s:COPTO =.*\":COPTO = -fPIC -o \":" \
- -e "s:LOPTO = .*\":LOPTO = ${LDFLAGS} -fPIC -o \":" \
- -e "s:CCFLAGS =.*\":CCFLAGS = ${CFLAGS}\":" \
- -e "s:CXXFLAGS =.*\":CXXFLAGS = ${CXXFLAGS}\":" \
- -e "s:SHLD = gcc:SHLD = $(tc-getCC) -shared:" \
- -e "s:SHXXLD = g++:SHXXLD = $(tc-getCXX) -shared:" \
- -e "s:-ltcl8.5:-ltcl:" \
- -i Make-arch || die "Failed to set up plugins Makefile"
-
- sed \
- -e '/^AR /s:=:?=:g' \
- -e '/^RANLIB /s:=:?=:g' \
- -i ../plugins/*/Makefile || die
-
- tc-export AR RANLIB
-
- sed \
- -e "s:\$(CXXFLAGS)::g" \
- -i hesstrans/Makefile || die
-
- # prepare vmd itself
- cd "${S}" || die
-
- eapply "${FILESDIR}"/${PN}-1.9.4-gentoo-paths.patch
-
- # https://www.ks.uiuc.edu/Research/vmd/mailing_list/vmd-l/32122.html
- eapply "${FILESDIR}"/${PN}-1.9.4-tmpdir.patch
-
- # PREFIX
- sed \
- -e "s:/usr/include/:${EPREFIX}/usr/include:g" \
- -i configure || die
-
- sed \
- -e "s:gentoo-bindir:${ED}/usr/bin:g" \
- -e "s:gentoo-libdir:${ED}/usr/$(get_libdir):g" \
- -e "s:gentoo-opengl-include:${EPREFIX}/usr/include/GL:g" \
- -e "s:gentoo-opengl-libs:${EPREFIX}/usr/$(get_libdir):g" \
- -e "s:gentoo-gcc:$(tc-getCC):g" \
- -e "s:gentoo-g++:$(tc-getCXX):g" \
- -e "s:gentoo-nvcc:${EPREFIX}/opt/cuda/bin/nvcc:g" \
- -e "s:gentoo-cflags:${CFLAGS}:g" \
- -e "s:gentoo-cxxflags:${CXXFLAGS}:g" \
- -e "s:gentoo-nvflags::g" \
- -e "s:gentoo-ldflags:${LDFLAGS}:g" \
- -e "s:gentoo-plugindir:${WORKDIR}/plugins:g" \
- -e "s:gentoo-fltk-include:$(fltk-config --includedir):g" \
- -e "s:gentoo-fltk-libs:$(dirname $(fltk-config --libs)) -Wl,-rpath,$(dirname $(fltk-config --libs)):g" \
- -e "s:gentoo-libtachyon-include:${EPREFIX}/usr/include/tachyon:g" \
- -e "s:gentoo-libtachyon-libs:${EPREFIX}/usr/$(get_libdir):g" \
- -e "s:gentoo-netcdf-include:${EPREFIX}/usr/include:g" \
- -e "s:gentoo-netcdf-libs:${EPREFIX}/usr/$(get_libdir):g" \
- -i configure || die
-
- if use cuda; then
- sed \
- -e "s:gentoo-cuda-lib:${EPREFIX}/opt/cuda/$(get_libdir):g" \
- -e "/NVCCFLAGS/s:=:= ${NVCCFLAGS}:g" \
- -i configure src/Makefile || die
- sed \
- -e '/compute_/d' \
- -i configure || die
- sed \
- -e 's:-gencode .*code=sm_..::' \
- -i src/Makefile || die
- fi
-
- sed \
- -e "s:LINUXPPC:LINUX:g" \
- -e "s:LINUXALPHA:LINUX:g" \
- -e "s:LINUXAMD64:LINUX:g" \
- -e "s:gentoo-stride:${EPREFIX}/usr/bin/stride:g" \
- -e "s:gentoo-surf:${EPREFIX}/usr/bin/surf:g" \
- -e "s:gentoo-tachyon:${EPREFIX}/usr/bin/tachyon:g" \
- -i "${S}"/bin/vmd.sh || die "failed setting up vmd wrapper script"
-
- EMAKEOPTS=(
- TCLINC="-I${EPREFIX}/usr/include"
- TCLLIB="-L${EPREFIX}/usr/$(get_libdir)"
- TCLLDFLAGS="-shared"
- NETCDFLIB="$($(tc-getPKG_CONFIG) --libs-only-L netcdf)${EPREFIX}/usr/$(get_libdir)/libnetcdf.so"
- NETCDFINC="$($(tc-getPKG_CONFIG) --cflags-only-I netcdf)${EPREFIX}/usr/include"
- NETCDFLDFLAGS="$($(tc-getPKG_CONFIG) --libs netcdf)"
- NETCDFDYNAMIC=1
- EXPATINC="-I${EPREFIX}/usr/include"
- EXPATLIB="$($(tc-getPKG_CONFIG) --libs expat)"
- EXPATLDFLAGS="-shared"
- EXPATDYNAMIC=1
- )
- if use gromacs; then
- EMAKEOPTS+=(
- TNGLIB="$($(tc-getPKG_CONFIG) --libs libgromacs)"
- TNGINC="-I${EPREFIX}/usr/include"
- TNGLDFLAGS="-shared"
- TNGDYNAMIC=1
- )
- fi
- if use sqlite; then
- EMAKEOPTS+=(
- SQLITELIB="$($(tc-getPKG_CONFIG) --libs sqlite3)"
- SQLITEINC="-I${EPREFIX}/usr/include"
- SQLITELDFLAGS="-shared"
- SQLITEDYNAMIC=1
- )
- fi
-}
-
-src_configure() {
- local myconf="OPENGL OPENGLPBUFFER COLVARS FLTK TK TCL PTHREADS PYTHON IMD NETCDF NUMPY NOSILENT XINPUT"
- rm -f configure.options && echo $myconf >> configure.options
-
- use cuda && myconf+=" CUDA"
-# use mpi && myconf+=" MPI"
- use tachyon && myconf+=" LIBTACHYON"
- use xinerama && myconf+=" XINERAMA"
-
- export \
- PYTHON_INCLUDE_DIR="$(python_get_includedir)" \
- PYTHON_LIBRARY_DIR="$(python_get_library_path)" \
- PYTHON_LIBRARY="$(python_get_LIBS)" \
- NUMPY_INCLUDE_DIR="$(python_get_sitedir)/numpy/core/include" \
- NUMPY_LIBRARY_DIR="$(python_get_sitedir)/numpy/core/include"
-
- perl ./configure LINUX \
- ${myconf} || die
-}
-
-src_compile() {
- # build plugins
- cd "${WORKDIR}"/plugins || die
-
- emake \
- ${EMAKEOPTS[@]} \
- LINUX
-
- # build vmd
- cd "${S}"/src || die
- emake
-}
-
-src_install() {
- # install plugins
- cd "${WORKDIR}"/plugins || die
- emake \
- PLUGINDIR="${ED}/usr/$(get_libdir)/${PN}/plugins" \
- distrib
-
- # install vmd
- cd "${S}"/src || die
- emake install
-
- # install docs
- cd "${S}" || die
- dodoc Announcement README doc/ig.pdf doc/ug.pdf
-
- # remove some of the things we don't want and need in
- # /usr/lib
- cd "${ED}"/usr/$(get_libdir)/vmd || die
- rm -fr doc README Announcement LICENSE || \
- die "failed to clean up /usr/lib/vmd directory"
-
- # adjust path in vmd wrapper
- sed \
- -e "s:${ED}::" -i "${ED}"/usr/bin/${PN} \
- -e "/^defaultvmddir/s:^.*$:defaultvmddir=\"${EPREFIX}/usr/$(get_libdir)/${PN}\":g" \
- || die "failed to set up vmd wrapper script"
-
- # install icon and generate desktop entry
- insinto /usr/share/pixmaps
- doins "${WORKDIR}"/vmd.png
- eprefixify "${WORKDIR}"/vmd.desktop
- sed -i '/^Path/d' "${WORKDIR}"/vmd.desktop || die
- # Open PDB files with VMD
- echo "MimeType=chemical/x-pdb;" >> "${WORKDIR}"/vmd.desktop || die
- domenu "${WORKDIR}"/vmd.desktop
-}