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authorRepository mirror & CI <repomirrorci@gentoo.org>2024-01-12 15:05:19 +0000
committerRepository mirror & CI <repomirrorci@gentoo.org>2024-01-12 15:05:19 +0000
commit1f3e88fd223e18ab94f31aaeae1c92d055516a34 (patch)
tree929f56488fb6b8492ca6cc916e9c8339d4b1f5bc /metadata/md5-cache/sci-chemistry
parentMerge updates from master (diff)
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2024-01-12 15:05:17 UTC
Diffstat (limited to 'metadata/md5-cache/sci-chemistry')
-rw-r--r--metadata/md5-cache/sci-chemistry/avogadro2-1.95.14
-rw-r--r--metadata/md5-cache/sci-chemistry/avogadro2-1.97.04
-rw-r--r--metadata/md5-cache/sci-chemistry/gelemental-2.0.0-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/gelemental-2.0.24
-rw-r--r--metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17_p6-r24
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2020.7-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2021.64
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2021.7-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2022.5-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2022.64
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2022.99994
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2023.1-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2023.24
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2023.99994
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2024.99994
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2024_beta4
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-99994
-rw-r--r--metadata/md5-cache/sci-chemistry/molequeue-0.9.0-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/mpqc-2.3.1-r44
-rw-r--r--metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p202102254
-rw-r--r--metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/openbabel-99994
22 files changed, 44 insertions, 44 deletions
diff --git a/metadata/md5-cache/sci-chemistry/avogadro2-1.95.1 b/metadata/md5-cache/sci-chemistry/avogadro2-1.95.1
index ac8598c30adc..60e6450643e1 100644
--- a/metadata/md5-cache/sci-chemistry/avogadro2-1.95.1
+++ b/metadata/md5-cache/sci-chemistry/avogadro2-1.95.1
@@ -1,4 +1,4 @@
-BDEPEND=doc? ( app-doc/doxygen media-gfx/graphviz ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=doc? ( app-text/doxygen media-gfx/graphviz ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst postrm preinst prepare test unpack
DEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtwidgets:5 >=sci-libs/avogadrolibs-1.95.1[qt5,vtk?] sci-libs/hdf5:= rpc? ( sci-chemistry/molequeue ) dev-cpp/eigen:3 test? ( dev-qt/qttest:5 )
DESCRIPTION=Advanced molecule editor and visualizer 2
@@ -13,5 +13,5 @@ RDEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtwidgets:5 >=sci-libs/avogadrolib
RESTRICT=test
SLOT=0
SRC_URI=https://github.com/OpenChemistry/avogadroapp/archive/1.95.1.tar.gz -> avogadro2-1.95.1.tar.gz https://github.com/OpenChemistry/avogadro-i18n/archive/3b8a86cc37e988b043d1503d2f11068389b0aca3.tar.gz -> avogadro2-1.95.1-i18n.tar.gz
-_eclasses_=desktop 021728fdc1b03b36357dbc89489e0f0d docs 74475974eae5130ba3e19b31b8ae46b8 toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 xdg 4a14c5c24f121e7da66e5aab4a168c6e
+_eclasses_=desktop 021728fdc1b03b36357dbc89489e0f0d docs 7f3c0d47338743498c69f1887a139f57 toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 xdg 4a14c5c24f121e7da66e5aab4a168c6e
_md5_=63852b6e1a0d593b6df49dc2b1b457f0
diff --git a/metadata/md5-cache/sci-chemistry/avogadro2-1.97.0 b/metadata/md5-cache/sci-chemistry/avogadro2-1.97.0
index 2f7bb210aab8..36cc6b330efd 100644
--- a/metadata/md5-cache/sci-chemistry/avogadro2-1.97.0
+++ b/metadata/md5-cache/sci-chemistry/avogadro2-1.97.0
@@ -1,4 +1,4 @@
-BDEPEND=doc? ( app-doc/doxygen media-gfx/graphviz ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=doc? ( app-text/doxygen media-gfx/graphviz ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst postrm preinst prepare test unpack
DEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtwidgets:5 >=sci-libs/avogadrolibs-1.97.0[qt5,vtk?] sci-libs/hdf5:= rpc? ( sci-chemistry/molequeue ) dev-cpp/eigen:3 test? ( dev-qt/qttest:5 )
DESCRIPTION=Advanced molecule editor and visualizer 2
@@ -13,5 +13,5 @@ RDEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtwidgets:5 >=sci-libs/avogadrolib
RESTRICT=test
SLOT=0
SRC_URI=https://github.com/OpenChemistry/avogadroapp/archive/1.97.0.tar.gz -> avogadro2-1.97.0.tar.gz https://github.com/OpenChemistry/avogadro-i18n/archive/13c4286102373658cea48a33b86536ab5793da66.tar.gz -> avogadro2-1.97.0-i18n.tar.gz
-_eclasses_=desktop 021728fdc1b03b36357dbc89489e0f0d docs 74475974eae5130ba3e19b31b8ae46b8 toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 xdg 4a14c5c24f121e7da66e5aab4a168c6e
+_eclasses_=desktop 021728fdc1b03b36357dbc89489e0f0d docs 7f3c0d47338743498c69f1887a139f57 toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 xdg 4a14c5c24f121e7da66e5aab4a168c6e
_md5_=4d16d471e4fb5d4f76219007401eda51
diff --git a/metadata/md5-cache/sci-chemistry/gelemental-2.0.0-r1 b/metadata/md5-cache/sci-chemistry/gelemental-2.0.0-r1
index 11469b9f01c1..1abba81dd444 100644
--- a/metadata/md5-cache/sci-chemistry/gelemental-2.0.0-r1
+++ b/metadata/md5-cache/sci-chemistry/gelemental-2.0.0-r1
@@ -1,4 +1,4 @@
-BDEPEND=dev-util/intltool sys-devel/gettext virtual/pkgconfig doc? ( app-doc/doxygen ) sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) || ( >=sys-devel/autoconf-2.72-r1:2.72 >=sys-devel/autoconf-2.71-r6:2.71 ) >=sys-devel/libtool-2.4.7
+BDEPEND=dev-util/intltool sys-devel/gettext virtual/pkgconfig doc? ( app-text/doxygen ) sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) || ( >=sys-devel/autoconf-2.72-r1:2.72 >=sys-devel/autoconf-2.71-r6:2.71 ) >=sys-devel/libtool-2.4.7
DEFINED_PHASES=configure install postinst postrm preinst prepare
DEPEND=dev-cpp/gtkmm:2.4 dev-cpp/glibmm:2 dev-util/desktop-file-utils x11-misc/shared-mime-info
DESCRIPTION=Periodic table viewer with detailed information on the chemical elements
@@ -12,4 +12,4 @@ RDEPEND=dev-cpp/gtkmm:2.4 dev-cpp/glibmm:2
SLOT=0
SRC_URI=https://github.com/ginggs/gelemental/archive/v2.0.0.tar.gz -> gelemental-2.0.0.tar.gz
_eclasses_=gnuconfig b6b3e92f8b8c996400074b5f61a59256 toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 libtool 9d3a9a889a6fa62ae794f817c156491b autotools 5f729b9cb10d5eda573cd604c93c6dc5 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a xdg-utils baea6080dd821f5562d715887954c9d3 xdg 4a14c5c24f121e7da66e5aab4a168c6e
-_md5_=48d951b4ec5cacae79105ead9aa3534e
+_md5_=e6c4f2d91d68cb5588f70952f51db5f6
diff --git a/metadata/md5-cache/sci-chemistry/gelemental-2.0.2 b/metadata/md5-cache/sci-chemistry/gelemental-2.0.2
index a72a641d20bf..19266a37580e 100644
--- a/metadata/md5-cache/sci-chemistry/gelemental-2.0.2
+++ b/metadata/md5-cache/sci-chemistry/gelemental-2.0.2
@@ -1,4 +1,4 @@
-BDEPEND=dev-util/intltool sys-devel/gettext virtual/pkgconfig doc? ( app-doc/doxygen ) sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) || ( >=sys-devel/autoconf-2.72-r1:2.72 >=sys-devel/autoconf-2.71-r6:2.71 ) >=sys-devel/libtool-2.4.7
+BDEPEND=dev-util/intltool sys-devel/gettext virtual/pkgconfig doc? ( app-text/doxygen ) sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) || ( >=sys-devel/autoconf-2.72-r1:2.72 >=sys-devel/autoconf-2.71-r6:2.71 ) >=sys-devel/libtool-2.4.7
DEFINED_PHASES=configure install postinst postrm preinst prepare
DEPEND=dev-cpp/gtkmm:2.4 dev-cpp/glibmm:2
DESCRIPTION=Periodic table viewer with detailed information on the chemical elements
@@ -13,4 +13,4 @@ RDEPEND=dev-cpp/gtkmm:2.4 dev-cpp/glibmm:2
SLOT=0
SRC_URI=https://github.com/ginggs/gelemental/archive/v2.0.2.tar.gz -> gelemental-2.0.2.tar.gz
_eclasses_=gnuconfig b6b3e92f8b8c996400074b5f61a59256 toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 libtool 9d3a9a889a6fa62ae794f817c156491b autotools 5f729b9cb10d5eda573cd604c93c6dc5 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a xdg-utils baea6080dd821f5562d715887954c9d3 xdg 4a14c5c24f121e7da66e5aab4a168c6e
-_md5_=bed3b8b22389aedb745825627f7dc60a
+_md5_=d981218a68da67f0cb9d487b33545477
diff --git a/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17_p6-r2 b/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17_p6-r2
index 7143b66fa529..85c88c1fe57d 100644
--- a/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17_p6-r2
+++ b/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17_p6-r2
@@ -1,4 +1,4 @@
-BDEPEND=app-doc/doxygen app-text/yelp-tools virtual/pkgconfig sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) || ( >=sys-devel/autoconf-2.72-r1:2.72 >=sys-devel/autoconf-2.71-r6:2.71 ) >=sys-devel/libtool-2.4.7
+BDEPEND=app-text/doxygen app-text/yelp-tools virtual/pkgconfig sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) || ( >=sys-devel/autoconf-2.72-r1:2.72 >=sys-devel/autoconf-2.71-r6:2.71 ) >=sys-devel/libtool-2.4.7
DEFINED_PHASES=configure install postinst postrm preinst prepare
DEPEND=>=dev-libs/glib-2.36.0:2 >=dev-libs/libxml2-2.4.16:2 >=gnome-extra/libgsf-1.14.9 >=sci-chemistry/bodr-5 >=sci-chemistry/chemical-mime-data-0.1.94 >=sci-chemistry/openbabel-2.3.0:0= >=x11-libs/cairo-1.6.0 >=x11-libs/gdk-pixbuf-2.22.0 >=x11-libs/goffice-0.10.12 x11-libs/gtk+:3[X] >=x11-libs/libX11-1.0.0 virtual/glu gnumeric? ( >=app-office/gnumeric-1.12.42:= )
DESCRIPTION=Programs and library containing GTK widgets and C++ classes related to chemistry
@@ -13,4 +13,4 @@ RDEPEND=>=dev-libs/glib-2.36.0:2 >=dev-libs/libxml2-2.4.16:2 >=gnome-extra/libgs
SLOT=0
SRC_URI=http://download.savannah.gnu.org/releases/gchemutils/0.14/gnome-chemistry-utils-0.14.17.tar.xz mirror://debian/pool/main/g/gnome-chemistry-utils/gnome-chemistry-utils_0.14.17-6.debian.tar.xz
_eclasses_=gnuconfig b6b3e92f8b8c996400074b5f61a59256 toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 libtool 9d3a9a889a6fa62ae794f817c156491b autotools 5f729b9cb10d5eda573cd604c93c6dc5 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a xdg-utils baea6080dd821f5562d715887954c9d3 xdg 4a14c5c24f121e7da66e5aab4a168c6e
-_md5_=25cbfd313caddda40b9210a79b2d402f
+_md5_=6e6bb6adab9851a4bcb2590675bf3466
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2020.7-r1 b/metadata/md5-cache/sci-chemistry/gromacs-2020.7-r1
index daa10e75d568..073fb694c46b 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2020.7-r1
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2020.7-r1
@@ -1,4 +1,4 @@
-BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14:= ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14:= ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -13,4 +13,4 @@ RESTRICT=!test? ( test )
SLOT=0/2020.7
SRC_URI=https://ftp.gromacs.org/gromacs/gromacs-2020.7.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2020.7.pdf ) test? ( https://ftp.gromacs.org/regressiontests/regressiontests-2020.7.tar.gz )
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3
-_md5_=d40495ba7090c595e2059b309a877501
+_md5_=ef9e447d3cb50094554c27ac05e1879d
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021.6 b/metadata/md5-cache/sci-chemistry/gromacs-2021.6
index 65ae7d333c58..d68ab58cbed8 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2021.6
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2021.6
@@ -1,4 +1,4 @@
-BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -13,4 +13,4 @@ RESTRICT=!test? ( test )
SLOT=0/2021.6
SRC_URI=https://ftp.gromacs.org/gromacs/gromacs-2021.6.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2021.6.pdf ) test? ( https://ftp.gromacs.org/regressiontests/regressiontests-2021.6.tar.gz )
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3
-_md5_=a1d35cded4ab63268211d99223aeacf7
+_md5_=917748eedc7283f70a8ef2dc99355f72
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021.7-r1 b/metadata/md5-cache/sci-chemistry/gromacs-2021.7-r1
index f5e6b0cea7e5..dc7ac630bbf5 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2021.7-r1
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2021.7-r1
@@ -1,4 +1,4 @@
-BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit:= ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -13,4 +13,4 @@ RESTRICT=!test? ( test )
SLOT=0/2021.7
SRC_URI=https://ftp.gromacs.org/gromacs/gromacs-2021.7.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2021.7.pdf ) test? ( https://ftp.gromacs.org/regressiontests/regressiontests-2021.7.tar.gz )
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3
-_md5_=4b0aa41558808feac8fca5b8a7590b92
+_md5_=c849542eba2fbee7ce887e8ea845ac98
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2022.5-r1 b/metadata/md5-cache/sci-chemistry/gromacs-2022.5-r1
index 31ae568a81fb..7ad19e215a22 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2022.5-r1
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2022.5-r1
@@ -1,4 +1,4 @@
-BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -13,4 +13,4 @@ RESTRICT=!test? ( test )
SLOT=0/2022.5
SRC_URI=https://ftp.gromacs.org/gromacs/gromacs-2022.5.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2022.5.pdf ) test? ( https://ftp.gromacs.org/regressiontests/regressiontests-2022.5.tar.gz )
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3
-_md5_=9c1c98b85f9cd9f4cb653f294a9724b8
+_md5_=54b2680c16d057b98219041b3fef8962
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2022.6 b/metadata/md5-cache/sci-chemistry/gromacs-2022.6
index 8cc0409db05b..dcbc06d48544 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2022.6
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2022.6
@@ -1,4 +1,4 @@
-BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -13,4 +13,4 @@ RESTRICT=!test? ( test )
SLOT=0/2022.6
SRC_URI=https://ftp.gromacs.org/gromacs/gromacs-2022.6.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2022.6.pdf ) test? ( https://ftp.gromacs.org/regressiontests/regressiontests-2022.6.tar.gz )
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3
-_md5_=9c1c98b85f9cd9f4cb653f294a9724b8
+_md5_=54b2680c16d057b98219041b3fef8962
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2022.9999 b/metadata/md5-cache/sci-chemistry/gromacs-2022.9999
index a27631e87ed9..276d0165c7f6 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2022.9999
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2022.9999
@@ -1,4 +1,4 @@
-BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl]
+BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl]
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -12,4 +12,4 @@ REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cud
RESTRICT=!test? ( test )
SLOT=0/2022.9999
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3 git-r3 86fa1f157b70b9d2ff340c4633b1cf4b
-_md5_=9c1c98b85f9cd9f4cb653f294a9724b8
+_md5_=54b2680c16d057b98219041b3fef8962
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2023.1-r1 b/metadata/md5-cache/sci-chemistry/gromacs-2023.1-r1
index 5a019a59a122..9aa4abd558c0 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2023.1-r1
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2023.1-r1
@@ -1,4 +1,4 @@
-BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -13,4 +13,4 @@ RESTRICT=!test? ( test )
SLOT=0/2023.1
SRC_URI=https://ftp.gromacs.org/gromacs/gromacs-2023.1.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2023.1.pdf ) test? ( https://ftp.gromacs.org/regressiontests/regressiontests-2023.1.tar.gz )
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3
-_md5_=691421bc1297877922d055d24f7e7e34
+_md5_=2913fa98274b71a930f88d0aaee5c3fd
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2023.2 b/metadata/md5-cache/sci-chemistry/gromacs-2023.2
index f128fa8baf2a..320123a72972 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2023.2
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2023.2
@@ -1,4 +1,4 @@
-BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -13,4 +13,4 @@ RESTRICT=!test? ( test )
SLOT=0/2023.2
SRC_URI=https://ftp.gromacs.org/gromacs/gromacs-2023.2.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2023.2.pdf ) test? ( https://ftp.gromacs.org/regressiontests/regressiontests-2023.2.tar.gz )
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3
-_md5_=691421bc1297877922d055d24f7e7e34
+_md5_=2913fa98274b71a930f88d0aaee5c3fd
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2023.9999 b/metadata/md5-cache/sci-chemistry/gromacs-2023.9999
index 1662d71b3c5c..2672366d0458 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2023.9999
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2023.9999
@@ -1,4 +1,4 @@
-BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl]
+BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl]
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -12,4 +12,4 @@ REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cud
RESTRICT=!test? ( test )
SLOT=0/2023.9999
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3 git-r3 86fa1f157b70b9d2ff340c4633b1cf4b
-_md5_=691421bc1297877922d055d24f7e7e34
+_md5_=2913fa98274b71a930f88d0aaee5c3fd
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2024.9999 b/metadata/md5-cache/sci-chemistry/gromacs-2024.9999
index 8ceae502be04..2b84bd08dc54 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2024.9999
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2024.9999
@@ -1,4 +1,4 @@
-BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl]
+BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl]
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -12,4 +12,4 @@ REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cud
RESTRICT=!test? ( test )
SLOT=0/2024.9999
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3 git-r3 86fa1f157b70b9d2ff340c4633b1cf4b
-_md5_=691421bc1297877922d055d24f7e7e34
+_md5_=2913fa98274b71a930f88d0aaee5c3fd
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2024_beta b/metadata/md5-cache/sci-chemistry/gromacs-2024_beta
index 2341b295d13d..973c7490e5ba 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2024_beta
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2024_beta
@@ -1,4 +1,4 @@
-BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -13,4 +13,4 @@ RESTRICT=!test? ( test )
SLOT=0/2024_beta
SRC_URI=https://ftp.gromacs.org/gromacs/gromacs-2024-beta.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2024-beta.pdf ) test? ( https://ftp.gromacs.org/regressiontests/regressiontests-2024-beta.tar.gz )
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3
-_md5_=691421bc1297877922d055d24f7e7e34
+_md5_=2913fa98274b71a930f88d0aaee5c3fd
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-9999 b/metadata/md5-cache/sci-chemistry/gromacs-9999
index f878feeccfca..a94997884bdb 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-9999
+++ b/metadata/md5-cache/sci-chemistry/gromacs-9999
@@ -1,4 +1,4 @@
-BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-doc/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl]
+BDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11:=[profiler] ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( sys-apps/hwloc:= ) lapack? ( virtual/lapack ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi[cxx] ) sci-libs/lmfit:= >=dev-cpp/muParser-2.3:= python_single_target_python3_10? ( dev-lang/python:3.10 ) python_single_target_python3_11? ( dev-lang/python:3.11 ) python_single_target_python3_12? ( dev-lang/python:3.12 ) virtual/pkgconfig clang? ( >=sys-devel/clang-6:* ) build-manual? ( app-text/doxygen python_single_target_python3_10? ( dev-python/sphinx[python_targets_python3_10(-)] dev-python/sphinx-copybutton[python_targets_python3_10(-)] dev-python/sphinx-inline-tabs[python_targets_python3_10(-)] dev-python/sphinx-argparse[python_targets_python3_10(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_10(-)] ) python_single_target_python3_11? ( dev-python/sphinx[python_targets_python3_11(-)] dev-python/sphinx-copybutton[python_targets_python3_11(-)] dev-python/sphinx-inline-tabs[python_targets_python3_11(-)] dev-python/sphinx-argparse[python_targets_python3_11(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_11(-)] ) python_single_target_python3_12? ( dev-python/sphinx[python_targets_python3_12(-)] dev-python/sphinx-copybutton[python_targets_python3_12(-)] dev-python/sphinx-inline-tabs[python_targets_python3_12(-)] dev-python/sphinx-argparse[python_targets_python3_12(-)] dev-python/sphinxcontrib-autoprogram[python_targets_python3_12(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) app-alternatives/ninja >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl]
DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
DESCRIPTION=The ultimate molecular dynamics simulation package
EAPI=8
@@ -12,4 +12,4 @@ REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cud
RESTRICT=!test? ( test )
SLOT=0/9999
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 cuda 283d0f298f6c196c755a0f8d50daca85 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-single-r1 75118e916668a74c660a13b0ecb22562 distutils-r1 b9318b5e40104e608d7e4582121fb561 readme.gentoo-r1 204091a2cde6179cd9d3db26d09412d3 git-r3 86fa1f157b70b9d2ff340c4633b1cf4b
-_md5_=691421bc1297877922d055d24f7e7e34
+_md5_=2913fa98274b71a930f88d0aaee5c3fd
diff --git a/metadata/md5-cache/sci-chemistry/molequeue-0.9.0-r1 b/metadata/md5-cache/sci-chemistry/molequeue-0.9.0-r1
index 83c2c665cb3e..1e1b76088a01 100644
--- a/metadata/md5-cache/sci-chemistry/molequeue-0.9.0-r1
+++ b/metadata/md5-cache/sci-chemistry/molequeue-0.9.0-r1
@@ -1,4 +1,4 @@
-BDEPEND=doc? ( app-doc/doxygen ) app-alternatives/ninja >=dev-util/cmake-3.20.5 test? ( x11-base/xorg-server[xvfb] x11-apps/xhost )
+BDEPEND=doc? ( app-text/doxygen ) app-alternatives/ninja >=dev-util/cmake-3.20.5 test? ( x11-base/xorg-server[xvfb] x11-apps/xhost )
DEFINED_PHASES=compile configure install prepare test
DEPEND=dev-qt/qtcore:5 dev-qt/qtgui:5 dev-qt/qtnetwork:5 dev-qt/qtwidgets:5 zeromq? ( python_targets_python3_10? ( dev-lang/python:3.10 ) python_targets_python3_11? ( dev-lang/python:3.11 ) net-libs/cppzmq:0= )
DESCRIPTION=Abstract, manage and coordinate execution of tasks
@@ -14,4 +14,4 @@ RESTRICT=test !test? ( test )
SLOT=0
SRC_URI=https://github.com/OpenChemistry/molequeue/archive/0.9.0.tar.gz -> molequeue-0.9.0.tar.gz
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 eapi8-dosym 5ac4857ad078256d939c44f7c64197a9 python-utils-r1 042f4cc53680245bf99a84669b94155a python-r1 8a28fa6d3e3bc96ff8a7eff2badbe71f virtualx 817571665ee28575da44ee08135089e5
-_md5_=1315f8fda2c7190895e00c847be437be
+_md5_=a108f91303f67878f78222fd95efc3ca
diff --git a/metadata/md5-cache/sci-chemistry/mpqc-2.3.1-r4 b/metadata/md5-cache/sci-chemistry/mpqc-2.3.1-r4
index ba1b3c9fcc55..ae9995e8f817 100644
--- a/metadata/md5-cache/sci-chemistry/mpqc-2.3.1-r4
+++ b/metadata/md5-cache/sci-chemistry/mpqc-2.3.1-r4
@@ -1,4 +1,4 @@
-BDEPEND=dev-lang/perl app-alternatives/lex virtual/pkgconfig doc? ( app-doc/doxygen media-gfx/graphviz ) sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) || ( >=sys-devel/autoconf-2.72-r1:2.72 >=sys-devel/autoconf-2.71-r6:2.71 ) >=sys-devel/libtool-2.4.7
+BDEPEND=dev-lang/perl app-alternatives/lex virtual/pkgconfig doc? ( app-text/doxygen media-gfx/graphviz ) sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) || ( >=sys-devel/autoconf-2.72-r1:2.72 >=sys-devel/autoconf-2.71-r6:2.71 ) >=sys-devel/libtool-2.4.7
DEFINED_PHASES=configure install postinst prepare test
DEPEND=virtual/blas virtual/lapack mpi? ( virtual/mpi[cxx] ) tk? ( dev-lang/tk:0 )
DESCRIPTION=The Massively Parallel Quantum Chemistry Program
@@ -12,4 +12,4 @@ RDEPEND=virtual/blas virtual/lapack mpi? ( virtual/mpi[cxx] ) tk? ( dev-lang/tk:
SLOT=0
SRC_URI=mirror://sourceforge/mpqc/mpqc-2.3.1.tar.bz2
_eclasses_=gnuconfig b6b3e92f8b8c996400074b5f61a59256 toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 libtool 9d3a9a889a6fa62ae794f817c156491b autotools 5f729b9cb10d5eda573cd604c93c6dc5
-_md5_=a8353d98c692657e19280dc9afd23389
+_md5_=b4a16e477503e5b15a3453d2e4f74ceb
diff --git a/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225 b/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225
index b536219cad71..4216ac98277a 100644
--- a/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225
+++ b/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225
@@ -1,4 +1,4 @@
-BDEPEND=dev-lang/perl doc? ( app-doc/doxygen dev-texlive/texlive-latex ) perl? ( >=dev-lang/swig-2 ) python? ( >=dev-lang/swig-2 ) test? ( dev-lang/python ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=dev-lang/perl doc? ( app-text/doxygen dev-texlive/texlive-latex ) perl? ( >=dev-lang/swig-2 ) python? ( >=dev-lang/swig-2 ) test? ( dev-lang/python ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst postrm prepare pretend setup test
DEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_10? ( dev-lang/python:3.10 ) python_targets_python3_11? ( dev-lang/python:3.11 ) ) wxwidgets? ( x11-libs/wxGTK:3.0-gtk3[X] ) perl? ( dev-lang/perl )
DESCRIPTION=Interconverts file formats used in molecular modeling
@@ -14,4 +14,4 @@ RESTRICT=!test? ( test )
SLOT=0/7.0.0
SRC_URI=https://github.com/openbabel/openbabel/archive/08e23f39b0cc39b4eebd937a5a2ffc1a7bac3e1b.tar.gz -> openbabel-3.1.1_p20210225.tar.gz https://openbabel.org/docs/dev/_static/babel130.png -> openbabel.png https://openbabel.org/OBTitle.jpg -> openbabel.jpg
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 desktop 021728fdc1b03b36357dbc89489e0f0d perl-functions c3fca037246e877693badea0df3b0ef8 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-r1 8a28fa6d3e3bc96ff8a7eff2badbe71f wxwidgets 9a707a3f9f1ea7aa703b1e46552291e5
-_md5_=41842cb4d1179218c4eab2269054b02f
+_md5_=ae4a96421ed1fc425728304cf498e389
diff --git a/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225-r1 b/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225-r1
index 894873aef3d2..cb3bafcbe41b 100644
--- a/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225-r1
+++ b/metadata/md5-cache/sci-chemistry/openbabel-3.1.1_p20210225-r1
@@ -1,4 +1,4 @@
-BDEPEND=dev-lang/perl doc? ( app-doc/doxygen dev-texlive/texlive-latex ) perl? ( >=dev-lang/swig-2 ) python? ( >=dev-lang/swig-2 ) test? ( dev-lang/python ) app-alternatives/ninja >=dev-util/cmake-3.20.5
+BDEPEND=dev-lang/perl doc? ( app-text/doxygen dev-texlive/texlive-latex ) perl? ( >=dev-lang/swig-2 ) python? ( >=dev-lang/swig-2 ) test? ( dev-lang/python ) app-alternatives/ninja >=dev-util/cmake-3.20.5
DEFINED_PHASES=compile configure install postinst postrm prepare pretend setup test
DEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_10? ( dev-lang/python:3.10 ) python_targets_python3_11? ( dev-lang/python:3.11 ) ) wxwidgets? ( x11-libs/wxGTK:3.2-gtk3[X] ) perl? ( dev-lang/perl )
DESCRIPTION=Interconverts file formats used in molecular modeling
@@ -14,4 +14,4 @@ RESTRICT=!test? ( test )
SLOT=0/7.0.0
SRC_URI=https://github.com/openbabel/openbabel/archive/08e23f39b0cc39b4eebd937a5a2ffc1a7bac3e1b.tar.gz -> openbabel-3.1.1_p20210225.tar.gz https://openbabel.org/docs/dev/_static/babel130.png -> openbabel.png https://openbabel.org/OBTitle.jpg -> openbabel.jpg
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 desktop 021728fdc1b03b36357dbc89489e0f0d perl-functions c3fca037246e877693badea0df3b0ef8 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-r1 8a28fa6d3e3bc96ff8a7eff2badbe71f wxwidgets 9a707a3f9f1ea7aa703b1e46552291e5
-_md5_=9594ff6dc68f04bbd2bda927caa395f8
+_md5_=2c2603143238c3b5fa33dec27adaae67
diff --git a/metadata/md5-cache/sci-chemistry/openbabel-9999 b/metadata/md5-cache/sci-chemistry/openbabel-9999
index e106a7a823d3..622a2c7db755 100644
--- a/metadata/md5-cache/sci-chemistry/openbabel-9999
+++ b/metadata/md5-cache/sci-chemistry/openbabel-9999
@@ -1,4 +1,4 @@
-BDEPEND=dev-lang/perl doc? ( app-doc/doxygen dev-texlive/texlive-latex ) perl? ( >=dev-lang/swig-2 ) python? ( >=dev-lang/swig-2 ) test? ( dev-lang/python ) app-alternatives/ninja >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl]
+BDEPEND=dev-lang/perl doc? ( app-text/doxygen dev-texlive/texlive-latex ) perl? ( >=dev-lang/swig-2 ) python? ( >=dev-lang/swig-2 ) test? ( dev-lang/python ) app-alternatives/ninja >=dev-util/cmake-3.20.5 >=dev-vcs/git-1.8.2.1[curl]
DEFINED_PHASES=compile configure install postinst postrm prepare pretend setup test unpack
DEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sys-libs/zlib:= inchi? ( sci-libs/inchi ) json? ( >=dev-libs/rapidjson-1.1.0 ) png? ( x11-libs/cairo ) python? ( python_targets_python3_10? ( dev-lang/python:3.10 ) python_targets_python3_11? ( dev-lang/python:3.11 ) ) wxwidgets? ( x11-libs/wxGTK:3.2-gtk3[X] ) perl? ( dev-lang/perl )
DESCRIPTION=Interconverts file formats used in molecular modeling
@@ -14,4 +14,4 @@ RESTRICT=!test? ( test )
SLOT=0/7.0.0
SRC_URI=https://openbabel.org/docs/dev/_static/babel130.png -> openbabel.png https://openbabel.org/OBTitle.jpg -> openbabel.jpg
_eclasses_=toolchain-funcs e56c7649b804f051623c8bc1a1c44084 multilib c19072c3cd7ac5cb21de013f7e9832e0 flag-o-matic 78cf3cc2d5572fddf5e5e10c70f7c81a multiprocessing 30ead54fa2e2b5f9cd4e612ffc34d0fe ninja-utils 2df4e452cea39a9ec8fb543ce059f8d6 xdg-utils baea6080dd821f5562d715887954c9d3 cmake 6ce0fba8085ef5b349c3a2e185305098 desktop 021728fdc1b03b36357dbc89489e0f0d perl-functions c3fca037246e877693badea0df3b0ef8 out-of-source-utils 1a9007554652a6e627edbccb3c25a439 multibuild d67e78a235f541871c7dfe4cf7931489 python-utils-r1 042f4cc53680245bf99a84669b94155a python-r1 8a28fa6d3e3bc96ff8a7eff2badbe71f wxwidgets 9a707a3f9f1ea7aa703b1e46552291e5 git-r3 86fa1f157b70b9d2ff340c4633b1cf4b
-_md5_=cc921fcb387fcad7c0f237cd5dbf4812
+_md5_=e993c1bcc1653108fde1c4a9feb22f37