gentoo resync : 14.12.2020

33 files changed, 90 insertions, 34 deletions

diff --git a/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.0 b/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.0
index fe6a58c6ed3f..d1eabcff87a3 100644
--- a/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.0
+++ b/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.0
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( python_targets_python3_6 python_targets_python3_7 )
 RESTRICT=!test? ( test )
 SLOT=0
 SRC_URI=https://github.com/Becksteinlab/GromacsWrapper/archive/release-0.8.0.tar.gz -> GromacsWrapper-0.8.0.tar.gz
-_eclasses_=distutils-r1	409cd1220f9f980d21980293a50e2a8e	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	l10n	8cdd85e169b835d518bc2fd59f780d8e	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-snapshot	b1abf460a493fc59ebb25de0df3f09dd	wrapper	4251d4c84c25f59094fd557e0063a974
+_eclasses_=distutils-r1	6492ae184ebb9d8124e5e0b23db93433	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	l10n	8cdd85e169b835d518bc2fd59f780d8e	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-snapshot	b1abf460a493fc59ebb25de0df3f09dd	wrapper	4251d4c84c25f59094fd557e0063a974
 _md5_=3932733dc9fd177f59a16d6e36038120
diff --git a/metadata/md5-cache/sci-chemistry/MDAnalysis-0.18.0-r1 b/metadata/md5-cache/sci-chemistry/MDAnalysis-0.18.0-r1
index 812ef0731a9d..1fb535a4b5ed 100644
--- a/metadata/md5-cache/sci-chemistry/MDAnalysis-0.18.0-r1
+++ b/metadata/md5-cache/sci-chemistry/MDAnalysis-0.18.0-r1
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( python_targets_python3_6 python_targets_python3_7 )
 RESTRICT=!test? ( test )
 SLOT=0
 SRC_URI=mirror://pypi/M/MDAnalysis/MDAnalysis-0.18.0.tar.gz
-_eclasses_=distutils-r1	409cd1220f9f980d21980293a50e2a8e	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
+_eclasses_=distutils-r1	6492ae184ebb9d8124e5e0b23db93433	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
 _md5_=38c5ed86ae5ece108464e88d0c780ff0
diff --git a/metadata/md5-cache/sci-chemistry/Manifest.gz b/metadata/md5-cache/sci-chemistry/Manifest.gz
index 7fc12af08a3a..5a6fe7b8f5c1 100644
--- a/metadata/md5-cache/sci-chemistry/Manifest.gz
+++ b/metadata/md5-cache/sci-chemistry/Manifest.gz
diff --git a/metadata/md5-cache/sci-chemistry/autodock-4.2.6 b/metadata/md5-cache/sci-chemistry/autodock-4.2.6
index 925ddfce0946..c3dc75af5dd3 100644
--- a/metadata/md5-cache/sci-chemistry/autodock-4.2.6
+++ b/metadata/md5-cache/sci-chemistry/autodock-4.2.6
@@ -8,5 +8,5 @@ KEYWORDS=~amd64 ~x86
 LICENSE=GPL-2
 SLOT=0
 SRC_URI=http://autodock.scripps.edu/downloads/autodock-registration/tars/dist426/autodocksuite-4.2.6-src.tar.gz
-_eclasses_=autotools	7d999b62b8749fad43fff00620cedf47	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
+_eclasses_=autotools	3ec5e49b810b2571ca9c6d76f55867bb	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
 _md5_=d7668bb3320103bf68b0e5508795e623
diff --git a/metadata/md5-cache/sci-chemistry/cara-bin-1.8.4-r2 b/metadata/md5-cache/sci-chemistry/cara-bin-1.8.4-r2
index b70ba83eb08c..e6d6a59bd675 100644
--- a/metadata/md5-cache/sci-chemistry/cara-bin-1.8.4-r2
+++ b/metadata/md5-cache/sci-chemistry/cara-bin-1.8.4-r2
@@ -1,12 +1,11 @@
 DEFINED_PHASES=install
 DESCRIPTION=Analysis of NMR spectra and Computer Aided Resonance Assignment
-EAPI=5
+EAPI=7
 HOMEPAGE=http://www.nmr.ch
-IUSE=lua
 KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux
 LICENSE=CARA
-RDEPEND=!prefix? ( >=media-libs/fontconfig-2.10.92[abi_x86_32(-)] >=media-libs/freetype-2.5.0.1[abi_x86_32(-)] >=x11-libs/libICE-1.0.8-r1[abi_x86_32(-)] >=x11-libs/libSM-1.2.1-r1[abi_x86_32(-)] >=x11-libs/libX11-1.6.2[abi_x86_32(-)] >=x11-libs/libXcursor-1.1.14[abi_x86_32(-)] >=x11-libs/libXext-1.3.2[abi_x86_32(-)] >=x11-libs/libXi-1.7.2[abi_x86_32(-)] >=x11-libs/libXrandr-1.4.2[abi_x86_32(-)] >=x11-libs/libXrender-0.9.8[abi_x86_32(-)] ) sys-libs/libstdc++-v3:5 lua? ( dev-lang/lua )
+RDEPEND=!prefix? ( >=media-libs/fontconfig-2.10.92[abi_x86_32(-)] >=media-libs/freetype-2.5.0.1[abi_x86_32(-)] >=x11-libs/libICE-1.0.8-r1[abi_x86_32(-)] >=x11-libs/libSM-1.2.1-r1[abi_x86_32(-)] >=x11-libs/libX11-1.6.2[abi_x86_32(-)] >=x11-libs/libXcursor-1.1.14[abi_x86_32(-)] >=x11-libs/libXext-1.3.2[abi_x86_32(-)] >=x11-libs/libXi-1.7.2[abi_x86_32(-)] >=x11-libs/libXrandr-1.4.2[abi_x86_32(-)] >=x11-libs/libXrender-0.9.8[abi_x86_32(-)] ) sys-libs/libstdc++-v3:5
 RESTRICT=bindist mirror
 SLOT=0
 SRC_URI=http://www.cara.nmr-software.org/downloads/cara_1.8.4_linux.gz https://dev.gentoo.org/~jlec/distfiles//Start1.2.cara.xz
-_md5_=84a636f69389fc737206addf663d8f9d
+_md5_=3331a572f96e34a2a75763846b65c7b3
diff --git a/metadata/md5-cache/sci-chemistry/chemex-2018.10.2 b/metadata/md5-cache/sci-chemistry/chemex-2018.10.2
index bb72019b9d7d..42636514a342 100644
--- a/metadata/md5-cache/sci-chemistry/chemex-2018.10.2
+++ b/metadata/md5-cache/sci-chemistry/chemex-2018.10.2
@@ -12,5 +12,5 @@ REQUIRED_USE=^^ ( python_single_target_python3_6 python_single_target_python3_7
 RESTRICT=!test? ( test )
 SLOT=0
 SRC_URI=https://github.com/gbouvignies/chemex/archive/2018.10.2.tar.gz -> chemex-2018.10.2.tar.gz
-_eclasses_=distutils-r1	409cd1220f9f980d21980293a50e2a8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
+_eclasses_=distutils-r1	6492ae184ebb9d8124e5e0b23db93433	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
 _md5_=a3b9076d5132b8f916d984b1ea8ea345
diff --git a/metadata/md5-cache/sci-chemistry/chemex-2018.10.3 b/metadata/md5-cache/sci-chemistry/chemex-2018.10.3
index b811b1903068..01fdb01d45e3 100644
--- a/metadata/md5-cache/sci-chemistry/chemex-2018.10.3
+++ b/metadata/md5-cache/sci-chemistry/chemex-2018.10.3
@@ -12,5 +12,5 @@ REQUIRED_USE=^^ ( python_single_target_python3_6 python_single_target_python3_7
 RESTRICT=!test? ( test )
 SLOT=0
 SRC_URI=https://github.com/gbouvignies/chemex/archive/2018.10.3.tar.gz -> chemex-2018.10.3.tar.gz
-_eclasses_=distutils-r1	409cd1220f9f980d21980293a50e2a8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
+_eclasses_=distutils-r1	6492ae184ebb9d8124e5e0b23db93433	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
 _md5_=682094d1deaf4d500e13aaa2f7f642f3
diff --git a/metadata/md5-cache/sci-chemistry/chemical-mime-data-0.1.94-r4 b/metadata/md5-cache/sci-chemistry/chemical-mime-data-0.1.94-r4
index 7ee2f356cbf4..e45765ae40a8 100644
--- a/metadata/md5-cache/sci-chemistry/chemical-mime-data-0.1.94-r4
+++ b/metadata/md5-cache/sci-chemistry/chemical-mime-data-0.1.94-r4
@@ -9,5 +9,5 @@ LICENSE=LGPL-2.1
 RDEPEND=x11-misc/shared-mime-info
 SLOT=0
 SRC_URI=mirror://sourceforge/chemical-mime/chemical-mime-data-0.1.94.tar.bz2
-_eclasses_=autotools	7d999b62b8749fad43fff00620cedf47	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	xdg	c7ba313ea1eaf266f95cc6235f7d6a07	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_eclasses_=autotools	3ec5e49b810b2571ca9c6d76f55867bb	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	xdg	c7ba313ea1eaf266f95cc6235f7d6a07	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=ef20453c790cdce1b95bf2825929168e
diff --git a/metadata/md5-cache/sci-chemistry/chemtool-1.6.14 b/metadata/md5-cache/sci-chemistry/chemtool-1.6.14
index d81b70a55a5a..dc9f70b4f7ad 100644
--- a/metadata/md5-cache/sci-chemistry/chemtool-1.6.14
+++ b/metadata/md5-cache/sci-chemistry/chemtool-1.6.14
@@ -10,5 +10,5 @@ LICENSE=GPL-2
 RDEPEND=dev-libs/glib:2 media-gfx/transfig x11-libs/gtk+:2 x11-libs/libX11 x11-libs/pango emf? ( media-libs/libemf )
 SLOT=0
 SRC_URI=http://ruby.chemie.uni-freiburg.de/~martin/chemtool/chemtool-1.6.14.tar.gz
-_eclasses_=autotools	7d999b62b8749fad43fff00620cedf47	desktop	7fd20552ce4cc97e8acb132a499a7dd8	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
+_eclasses_=autotools	3ec5e49b810b2571ca9c6d76f55867bb	desktop	7fd20552ce4cc97e8acb132a499a7dd8	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
 _md5_=ec2a33e3b596e37ff37f7d67c3756378
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 8583ad6eff5c..11420e213aec 100644
--- a/metadata/md5-cache/sci-chemistry/gelemental-2.0.0-r1
+++ b/metadata/md5-cache/sci-chemistry/gelemental-2.0.0-r1
@@ -10,5 +10,5 @@ LICENSE=GPL-3 MIT
 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_=autotools	7d999b62b8749fad43fff00620cedf47	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_eclasses_=autotools	3ec5e49b810b2571ca9c6d76f55867bb	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=b50ee307aad70b9722f1cd9a1efaf38f
diff --git a/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17 b/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17
index a01d1f942b61..22dcbaf6f034 100644
--- a/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17
+++ b/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17
@@ -10,5 +10,5 @@ LICENSE=GPL-3
 RDEPEND=>=app-text/gnome-doc-utils-0.3.2 >=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 >=x11-libs/libX11-1.0.0 gnumeric? ( >=app-office/gnumeric-1.12.42 )
 SLOT=0
 SRC_URI=http://download.savannah.gnu.org/releases/gchemutils/0.14/gnome-chemistry-utils-0.14.17.tar.xz
-_eclasses_=autotools	7d999b62b8749fad43fff00620cedf47	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	xdg	c7ba313ea1eaf266f95cc6235f7d6a07	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_eclasses_=autotools	3ec5e49b810b2571ca9c6d76f55867bb	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	xdg	c7ba313ea1eaf266f95cc6235f7d6a07	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=acb40cfeef03de4c4bdba011193ec2de
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2020.4 b/metadata/md5-cache/sci-chemistry/gromacs-2020.4
index 15a7f180897e..0e52eef5504e 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2020.4
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2020.4
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( single-precision double-precision ) cuda? ( single-precision )
 RESTRICT=!test? ( test )
 SLOT=0/2020.4
 SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2020.4.tar.gz test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2020.4.tar.gz )
-_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	cuda	c2f1b334711bbbf2130f339636dc7515	distutils-r1	409cd1220f9f980d21980293a50e2a8e	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	cuda	c2f1b334711bbbf2130f339636dc7515	distutils-r1	6492ae184ebb9d8124e5e0b23db93433	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=8ad278ae7cdbbc81c13e4302e0889796
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2020.9999 b/metadata/md5-cache/sci-chemistry/gromacs-2020.9999
index e1455f653502..4d9730ae0ca7 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2020.9999
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2020.9999
@@ -10,5 +10,5 @@ RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/bl
 REQUIRED_USE=|| ( single-precision double-precision ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_6 python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9 ) ^^ ( python_single_target_python3_6 python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9 )
 RESTRICT=!test? ( test )
 SLOT=0/2020.9999
-_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	cuda	c2f1b334711bbbf2130f339636dc7515	distutils-r1	409cd1220f9f980d21980293a50e2a8e	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	git-r3	3e7ec3d6619213460c85e2aa48398441	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	cuda	c2f1b334711bbbf2130f339636dc7515	distutils-r1	6492ae184ebb9d8124e5e0b23db93433	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	git-r3	3e7ec3d6619213460c85e2aa48398441	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=c7ed99f37bdad2029e7699e7ed38dd7c
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021.9999 b/metadata/md5-cache/sci-chemistry/gromacs-2021.9999
index ec042c103290..3d904a342530 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2021.9999
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2021.9999
@@ -10,5 +10,5 @@ RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/bl
 REQUIRED_USE=|| ( single-precision double-precision ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_6 python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9 ) ^^ ( python_single_target_python3_6 python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9 )
 RESTRICT=!test? ( test )
 SLOT=0/2021.9999
-_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	cuda	c2f1b334711bbbf2130f339636dc7515	distutils-r1	409cd1220f9f980d21980293a50e2a8e	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	git-r3	3e7ec3d6619213460c85e2aa48398441	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	cuda	c2f1b334711bbbf2130f339636dc7515	distutils-r1	6492ae184ebb9d8124e5e0b23db93433	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	git-r3	3e7ec3d6619213460c85e2aa48398441	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=4497a41d52b81443df41b8ed2d791e7c
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021_beta2 b/metadata/md5-cache/sci-chemistry/gromacs-2021_beta3
index a53557760bbc..19069fc493a1 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2021_beta2
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2021_beta3
@@ -9,7 +9,7 @@ LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD )
 RDEPEND=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_6? ( dev-lang/python:3.6 >=dev-lang/python-exec-2:=[python_targets_python3_6] ) python_single_target_python3_7? ( dev-lang/python:3.7 >=dev-lang/python-exec-2:=[python_targets_python3_7] ) python_single_target_python3_8? ( dev-lang/python:3.8 >=dev-lang/python-exec-2:=[python_targets_python3_8] ) python_single_target_python3_9? ( dev-lang/python:3.9 >=dev-lang/python-exec-2:=[python_targets_python3_9] ) !sci-chemistry/gmxapi python_single_target_python3_6? ( dev-lang/python:3.6 >=dev-lang/python-exec-2:=[python_targets_python3_6] ) python_single_target_python3_7? ( dev-lang/python:3.7 >=dev-lang/python-exec-2:=[python_targets_python3_7] ) python_single_target_python3_8? ( dev-lang/python:3.8 >=dev-lang/python-exec-2:=[python_targets_python3_8] ) python_single_target_python3_9? ( dev-lang/python:3.9 >=dev-lang/python-exec-2:=[python_targets_python3_9] )
 REQUIRED_USE=|| ( single-precision double-precision ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_6 python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9 ) ^^ ( python_single_target_python3_6 python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9 )
 RESTRICT=!test? ( test )
-SLOT=0/2021_beta2
-SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2021-beta2.tar.gz test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2021-beta2.tar.gz )
-_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	cuda	c2f1b334711bbbf2130f339636dc7515	distutils-r1	409cd1220f9f980d21980293a50e2a8e	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+SLOT=0/2021_beta3
+SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2021-beta3.tar.gz test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2021-beta3.tar.gz )
+_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	cuda	c2f1b334711bbbf2130f339636dc7515	distutils-r1	6492ae184ebb9d8124e5e0b23db93433	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=4497a41d52b81443df41b8ed2d791e7c
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-9999 b/metadata/md5-cache/sci-chemistry/gromacs-9999
index 3d8c4952972f..e12fd8d04cae 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-9999
+++ b/metadata/md5-cache/sci-chemistry/gromacs-9999
@@ -10,5 +10,5 @@ RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/bl
 REQUIRED_USE=|| ( single-precision double-precision ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_6 python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9 ) ^^ ( python_single_target_python3_6 python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9 )
 RESTRICT=!test? ( test )
 SLOT=0/9999
-_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	cuda	c2f1b334711bbbf2130f339636dc7515	distutils-r1	409cd1220f9f980d21980293a50e2a8e	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	git-r3	3e7ec3d6619213460c85e2aa48398441	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	cuda	c2f1b334711bbbf2130f339636dc7515	distutils-r1	6492ae184ebb9d8124e5e0b23db93433	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	git-r3	3e7ec3d6619213460c85e2aa48398441	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	readme.gentoo-r1	22ae82e140bdd95d17a34fd5fd733190	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=4497a41d52b81443df41b8ed2d791e7c
diff --git a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.1 b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.1
index 5efa39e9abf8..a0bb32ab353b 100644
--- a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.1
+++ b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.1
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( python_targets_python3_6 )
 RESTRICT=!test? ( test )
 SLOT=0
 SRC_URI=mirror://pypi/m/mdtraj/mdtraj-1.9.1.tar.gz
-_eclasses_=desktop	7fd20552ce4cc97e8acb132a499a7dd8	distutils-r1	409cd1220f9f980d21980293a50e2a8e	edos2unix	33e347e171066657f91f8b0c72ec8773	epatch	e8f1ec13660dc2f44b32775765d85e42	estack	686eaab303305a908fd57b2fd7617800	eutils	2d5b3f4b315094768576b6799e4f926e	l10n	8cdd85e169b835d518bc2fd59f780d8e	ltprune	4f3f2db5ce3ccbeeacdf3f94954043aa	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	preserve-libs	ef207dc62baddfddfd39a164d9797648	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-clean	2a0f74a496fa2b1552c4f3398258b7bf	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_eclasses_=desktop	7fd20552ce4cc97e8acb132a499a7dd8	distutils-r1	6492ae184ebb9d8124e5e0b23db93433	edos2unix	33e347e171066657f91f8b0c72ec8773	epatch	e8f1ec13660dc2f44b32775765d85e42	estack	686eaab303305a908fd57b2fd7617800	eutils	2d5b3f4b315094768576b6799e4f926e	l10n	8cdd85e169b835d518bc2fd59f780d8e	ltprune	4f3f2db5ce3ccbeeacdf3f94954043aa	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	preserve-libs	ef207dc62baddfddfd39a164d9797648	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-clean	2a0f74a496fa2b1552c4f3398258b7bf	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=3679ad7edb4bbd083ab88fc471d38274
diff --git a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4 b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4
index 3d82fa329e8c..41ce492f5915 100644
--- a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4
+++ b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4
@@ -12,5 +12,5 @@ REQUIRED_USE=|| ( python_targets_python3_6 python_targets_python3_7 python_targe
 RESTRICT=test
 SLOT=0
 SRC_URI=mirror://pypi/m/mdtraj/mdtraj-1.9.4.tar.gz
-_eclasses_=distutils-r1	409cd1220f9f980d21980293a50e2a8e	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
+_eclasses_=distutils-r1	6492ae184ebb9d8124e5e0b23db93433	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
 _md5_=407e11f2f53ac560a1ee704890ef1fd6
diff --git a/metadata/md5-cache/sci-chemistry/modeller-9.25 b/metadata/md5-cache/sci-chemistry/modeller-9.25
new file mode 100644
index 000000000000..c5267d7916fa
--- /dev/null
+++ b/metadata/md5-cache/sci-chemistry/modeller-9.25
@@ -0,0 +1,16 @@
+BDEPEND=python_targets_python3_6? ( dev-lang/python:3.6 ) python_targets_python3_7? ( dev-lang/python:3.7 ) python_targets_python3_8? ( dev-lang/python:3.8 ) python_targets_python3_9? ( dev-lang/python:3.9 ) >=dev-lang/python-exec-2:=[python_targets_python3_6(-)?,python_targets_python3_7(-)?,python_targets_python3_8(-)?,python_targets_python3_9(-)?,-python_single_target_python3_6(-),-python_single_target_python3_7(-),-python_single_target_python3_8(-),-python_single_target_python3_9(-)]
+DEFINED_PHASES=compile config configure install postinst postrm prepare setup test
+DEPEND=>=dev-lang/swig-1.3
+DESCRIPTION=Homology or comparative modeling of protein three-dimensional structures
+EAPI=7
+HOMEPAGE=https://salilab.org/modeller/
+IUSE=doc examples python_targets_python3_6 python_targets_python3_7 python_targets_python3_8 python_targets_python3_9
+KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux
+LICENSE=modeller
+RDEPEND=python_targets_python3_6? ( dev-lang/python:3.6 ) python_targets_python3_7? ( dev-lang/python:3.7 ) python_targets_python3_8? ( dev-lang/python:3.8 ) python_targets_python3_9? ( dev-lang/python:3.9 ) >=dev-lang/python-exec-2:=[python_targets_python3_6(-)?,python_targets_python3_7(-)?,python_targets_python3_8(-)?,python_targets_python3_9(-)?,-python_single_target_python3_6(-),-python_single_target_python3_7(-),-python_single_target_python3_8(-),-python_single_target_python3_9(-)]
+REQUIRED_USE=|| ( python_targets_python3_6 python_targets_python3_7 python_targets_python3_8 python_targets_python3_9 )
+RESTRICT=mirror
+SLOT=0
+SRC_URI=https://salilab.org/modeller/9.25/modeller-9.25.tar.gz
+_eclasses_=distutils-r1	6492ae184ebb9d8124e5e0b23db93433	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	l10n	8cdd85e169b835d518bc2fd59f780d8e	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974
+_md5_=45122340aacf95ad7628b2d4863af77a
diff --git a/metadata/md5-cache/sci-chemistry/mopac7-1.15-r1 b/metadata/md5-cache/sci-chemistry/mopac7-1.15-r1
index b1b995aad5dc..67c3344f6d9b 100644
--- a/metadata/md5-cache/sci-chemistry/mopac7-1.15-r1
+++ b/metadata/md5-cache/sci-chemistry/mopac7-1.15-r1
@@ -9,5 +9,5 @@ LICENSE=public-domain
 RDEPEND=dev-libs/libf2c virtual/fortran
 SLOT=0
 SRC_URI=http://www.bioinformatics.org/ghemical/download/current/mopac7-1.15.tar.gz http://wwwuser.gwdg.de/~ggroenh/qmmm/mopac/dcart.f http://wwwuser.gwdg.de/~ggroenh/qmmm/mopac/gmxmop.f
-_eclasses_=autotools	7d999b62b8749fad43fff00620cedf47	desktop	7fd20552ce4cc97e8acb132a499a7dd8	edos2unix	33e347e171066657f91f8b0c72ec8773	epatch	e8f1ec13660dc2f44b32775765d85e42	estack	686eaab303305a908fd57b2fd7617800	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	fortran-2	b4796813ccda91c9c0d3463fc90aa969	l10n	8cdd85e169b835d518bc2fd59f780d8e	libtool	f143db5a74ccd9ca28c1234deffede96	ltprune	4f3f2db5ce3ccbeeacdf3f94954043aa	multilib	d410501a125f99ffb560b0c523cd3d1e	preserve-libs	ef207dc62baddfddfd39a164d9797648	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-clean	2a0f74a496fa2b1552c4f3398258b7bf	wrapper	4251d4c84c25f59094fd557e0063a974
+_eclasses_=autotools	3ec5e49b810b2571ca9c6d76f55867bb	desktop	7fd20552ce4cc97e8acb132a499a7dd8	edos2unix	33e347e171066657f91f8b0c72ec8773	epatch	e8f1ec13660dc2f44b32775765d85e42	estack	686eaab303305a908fd57b2fd7617800	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	fortran-2	b4796813ccda91c9c0d3463fc90aa969	l10n	8cdd85e169b835d518bc2fd59f780d8e	libtool	f143db5a74ccd9ca28c1234deffede96	ltprune	4f3f2db5ce3ccbeeacdf3f94954043aa	multilib	d410501a125f99ffb560b0c523cd3d1e	preserve-libs	ef207dc62baddfddfd39a164d9797648	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-clean	2a0f74a496fa2b1552c4f3398258b7bf	wrapper	4251d4c84c25f59094fd557e0063a974
 _md5_=3771f029b2ebed87ddf490178be003a2
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 31bec36f9eda..71372d39d85c 100644
--- a/metadata/md5-cache/sci-chemistry/mpqc-2.3.1-r4
+++ b/metadata/md5-cache/sci-chemistry/mpqc-2.3.1-r4
@@ -9,5 +9,5 @@ LICENSE=GPL-2
 RDEPEND=virtual/blas virtual/lapack mpi? ( virtual/mpi[cxx] ) tk? ( dev-lang/tk:0 )
 SLOT=0
 SRC_URI=mirror://sourceforge/mpqc/mpqc-2.3.1.tar.bz2
-_eclasses_=autotools	7d999b62b8749fad43fff00620cedf47	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
+_eclasses_=autotools	3ec5e49b810b2571ca9c6d76f55867bb	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
 _md5_=a765f25fee693dd1943023f3b114039b
diff --git a/metadata/md5-cache/sci-chemistry/nmrglue-0.5-r1 b/metadata/md5-cache/sci-chemistry/nmrglue-0.5-r1
index ec375f15a1b5..5bfbc7e3cb58 100644
--- a/metadata/md5-cache/sci-chemistry/nmrglue-0.5-r1
+++ b/metadata/md5-cache/sci-chemistry/nmrglue-0.5-r1
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( python_targets_python3_6 )
 RESTRICT=!test? ( test )
 SLOT=0
 SRC_URI=https://github.com/jjhelmus/nmrglue/releases/download/v0.5/nmrglue-0.5.tar.gz
-_eclasses_=desktop	7fd20552ce4cc97e8acb132a499a7dd8	distutils-r1	409cd1220f9f980d21980293a50e2a8e	edos2unix	33e347e171066657f91f8b0c72ec8773	epatch	e8f1ec13660dc2f44b32775765d85e42	estack	686eaab303305a908fd57b2fd7617800	eutils	2d5b3f4b315094768576b6799e4f926e	l10n	8cdd85e169b835d518bc2fd59f780d8e	ltprune	4f3f2db5ce3ccbeeacdf3f94954043aa	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	preserve-libs	ef207dc62baddfddfd39a164d9797648	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-clean	2a0f74a496fa2b1552c4f3398258b7bf	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_eclasses_=desktop	7fd20552ce4cc97e8acb132a499a7dd8	distutils-r1	6492ae184ebb9d8124e5e0b23db93433	edos2unix	33e347e171066657f91f8b0c72ec8773	epatch	e8f1ec13660dc2f44b32775765d85e42	estack	686eaab303305a908fd57b2fd7617800	eutils	2d5b3f4b315094768576b6799e4f926e	l10n	8cdd85e169b835d518bc2fd59f780d8e	ltprune	4f3f2db5ce3ccbeeacdf3f94954043aa	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	preserve-libs	ef207dc62baddfddfd39a164d9797648	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-clean	2a0f74a496fa2b1552c4f3398258b7bf	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=98e1c85234da0f89ab5a0caf323fe699
diff --git a/metadata/md5-cache/sci-chemistry/nmrglue-0.7 b/metadata/md5-cache/sci-chemistry/nmrglue-0.7
index 964d76eb2202..c2cc27db1ed9 100644
--- a/metadata/md5-cache/sci-chemistry/nmrglue-0.7
+++ b/metadata/md5-cache/sci-chemistry/nmrglue-0.7
@@ -12,5 +12,5 @@ REQUIRED_USE=|| ( python_targets_python3_6 python_targets_python3_7 python_targe
 RESTRICT=!test? ( test )
 SLOT=0
 SRC_URI=https://github.com/jjhelmus/nmrglue/releases/download/v0.7/nmrglue-0.7.tar.gz
-_eclasses_=distutils-r1	409cd1220f9f980d21980293a50e2a8e	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
+_eclasses_=distutils-r1	6492ae184ebb9d8124e5e0b23db93433	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
 _md5_=104f5a98bd5a8b0c23ea72e2e8497e5b
diff --git a/metadata/md5-cache/sci-chemistry/numbat-0.999-r1 b/metadata/md5-cache/sci-chemistry/numbat-0.999-r1
index 51ced3a5a7e0..5321aca7c4ea 100644
--- a/metadata/md5-cache/sci-chemistry/numbat-0.999-r1
+++ b/metadata/md5-cache/sci-chemistry/numbat-0.999-r1
@@ -8,5 +8,5 @@ LICENSE=GPL-3
 RDEPEND=gnome-base/libglade:2.0 sci-libs/gsl x11-libs/gtk+:2 sci-chemistry/molmol sci-chemistry/pymol sci-visualization/gnuplot
 SLOT=0
 SRC_URI=http://comp-bio.anu.edu.au/private/downloads/Numbat/Numbat-0.999.tar.gz
-_eclasses_=autotools	7d999b62b8749fad43fff00620cedf47	autotools-utils	961893b8004e6cf64fbef1cea6ed8bd2	desktop	7fd20552ce4cc97e8acb132a499a7dd8	edos2unix	33e347e171066657f91f8b0c72ec8773	epatch	e8f1ec13660dc2f44b32775765d85e42	estack	686eaab303305a908fd57b2fd7617800	eutils	2d5b3f4b315094768576b6799e4f926e	l10n	8cdd85e169b835d518bc2fd59f780d8e	libtool	f143db5a74ccd9ca28c1234deffede96	ltprune	4f3f2db5ce3ccbeeacdf3f94954043aa	multilib	d410501a125f99ffb560b0c523cd3d1e	preserve-libs	ef207dc62baddfddfd39a164d9797648	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-clean	2a0f74a496fa2b1552c4f3398258b7bf	wrapper	4251d4c84c25f59094fd557e0063a974
+_eclasses_=autotools	3ec5e49b810b2571ca9c6d76f55867bb	autotools-utils	961893b8004e6cf64fbef1cea6ed8bd2	desktop	7fd20552ce4cc97e8acb132a499a7dd8	edos2unix	33e347e171066657f91f8b0c72ec8773	epatch	e8f1ec13660dc2f44b32775765d85e42	estack	686eaab303305a908fd57b2fd7617800	eutils	2d5b3f4b315094768576b6799e4f926e	l10n	8cdd85e169b835d518bc2fd59f780d8e	libtool	f143db5a74ccd9ca28c1234deffede96	ltprune	4f3f2db5ce3ccbeeacdf3f94954043aa	multilib	d410501a125f99ffb560b0c523cd3d1e	preserve-libs	ef207dc62baddfddfd39a164d9797648	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-clean	2a0f74a496fa2b1552c4f3398258b7bf	wrapper	4251d4c84c25f59094fd557e0063a974
 _md5_=3b685285507fad73053fa0418f660969
diff --git a/metadata/md5-cache/sci-chemistry/openbabel-2.4.1-r1 b/metadata/md5-cache/sci-chemistry/openbabel-2.4.1-r1
index bbb25bed1918..39c55b05ba84 100644
--- a/metadata/md5-cache/sci-chemistry/openbabel-2.4.1-r1
+++ b/metadata/md5-cache/sci-chemistry/openbabel-2.4.1-r1
@@ -5,11 +5,11 @@ DESCRIPTION=Interconverts file formats used in molecular modeling
 EAPI=7
 HOMEPAGE=http://openbabel.org/wiki/Main_Page
 IUSE=doc openmp test wxwidgets
-KEYWORDS=~amd64 ~arm ~x86 ~amd64-linux ~x86-linux ~ppc-macos
+KEYWORDS=~amd64 ~arm x86 ~amd64-linux ~x86-linux ~ppc-macos
 LICENSE=GPL-2
 RDEPEND=dev-cpp/eigen:3 dev-libs/libxml2:2 sci-libs/inchi sys-libs/zlib wxwidgets? ( x11-libs/wxGTK:3.0[X] )
 RESTRICT=!test? ( test )
 SLOT=0/5.0.0
 SRC_URI=mirror://sourceforge/openbabel/openbabel-2.4.1.tar.gz https://openbabel.org/docs/dev/_static/babel130.png -> openbabel.png
 _eclasses_=cmake-utils	77cd39e6009811bf97a59d91ffd5b54f	desktop	7fd20552ce4cc97e8acb132a499a7dd8	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	optfeature	6c9aa35fc16df43d7142ef2660e00e25	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	wxwidgets	e1e6e1eb5b3d911b3abd712f611e2312	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
-_md5_=3c87a60ce425f5a7d62f7e9e92f095a1
+_md5_=a754f45bd0c575119ad466190e62eb3b
diff --git a/metadata/md5-cache/sci-chemistry/propka-3.2.0 b/metadata/md5-cache/sci-chemistry/propka-3.2.0
index 1984c7792589..c38a85e0831f 100644
--- a/metadata/md5-cache/sci-chemistry/propka-3.2.0
+++ b/metadata/md5-cache/sci-chemistry/propka-3.2.0
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( python_targets_python3_7 python_targets_python3_8 )
 RESTRICT=!test? ( test )
 SLOT=0
 SRC_URI=mirror://pypi/p/propka/propka-3.2.0.tar.gz
-_eclasses_=distutils-r1	409cd1220f9f980d21980293a50e2a8e	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
+_eclasses_=distutils-r1	6492ae184ebb9d8124e5e0b23db93433	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
 _md5_=bd048f5978b21207dd0a67d80964171d
diff --git a/metadata/md5-cache/sci-chemistry/psi-3.4.0-r2 b/metadata/md5-cache/sci-chemistry/psi-3.4.0-r2
index 90b2b2d67e73..a3a7c8690ee1 100644
--- a/metadata/md5-cache/sci-chemistry/psi-3.4.0-r2
+++ b/metadata/md5-cache/sci-chemistry/psi-3.4.0-r2
@@ -11,5 +11,5 @@ RDEPEND=!sci-visualization/extrema virtual/blas virtual/lapack >=sci-libs/libint
 RESTRICT=test
 SLOT=0
 SRC_URI=mirror://sourceforge/psicode/psi-3.4.0.tar.gz
-_eclasses_=autotools	7d999b62b8749fad43fff00620cedf47	fortran-2	b4796813ccda91c9c0d3463fc90aa969	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
+_eclasses_=autotools	3ec5e49b810b2571ca9c6d76f55867bb	fortran-2	b4796813ccda91c9c0d3463fc90aa969	libtool	f143db5a74ccd9ca28c1234deffede96	multilib	d410501a125f99ffb560b0c523cd3d1e	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb
 _md5_=ecd9eddd7cba15554c7599004f94761a
diff --git a/metadata/md5-cache/sci-chemistry/pymol-2.4.0 b/metadata/md5-cache/sci-chemistry/pymol-2.4.0
index d8f58dd04417..efb3fdabfaaa 100644
--- a/metadata/md5-cache/sci-chemistry/pymol-2.4.0
+++ b/metadata/md5-cache/sci-chemistry/pymol-2.4.0
@@ -12,5 +12,5 @@ REQUIRED_USE=|| ( python_targets_python3_6 python_targets_python3_7 python_targe
 RESTRICT=mirror
 SLOT=0
 SRC_URI=https://dev.gentoo.org/~jlec/distfiles/pymol-1.8.4.0.png.xz https://github.com/schrodinger/pymol-open-source/archive/v2.4.0.tar.gz -> pymol-2.4.0.tar.gz
-_eclasses_=desktop	7fd20552ce4cc97e8acb132a499a7dd8	distutils-r1	409cd1220f9f980d21980293a50e2a8e	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	optfeature	6c9aa35fc16df43d7142ef2660e00e25	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_eclasses_=desktop	7fd20552ce4cc97e8acb132a499a7dd8	distutils-r1	6492ae184ebb9d8124e5e0b23db93433	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multibuild	b2c915190b051f55a23b9354b9849847	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	optfeature	6c9aa35fc16df43d7142ef2660e00e25	python-r1	8d03325e7e3cf3e1465d9c32031e2517	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
 _md5_=dfc3fd4ee81b72f28e6e1a3403d71391
diff --git a/metadata/md5-cache/sci-chemistry/vmd-1.9.4_alpha43 b/metadata/md5-cache/sci-chemistry/vmd-1.9.4_alpha43
index e027e34c39ce..78f751bc9641 100644
--- a/metadata/md5-cache/sci-chemistry/vmd-1.9.4_alpha43
+++ b/metadata/md5-cache/sci-chemistry/vmd-1.9.4_alpha43
@@ -13,4 +13,4 @@ RESTRICT=fetch
 SLOT=0
 SRC_URI=vmd-1.9.4a43.src.tar https://dev.gentoo.org/~jlec/distfiles/vmd-1.9.3-gentoo-patches.tar.xz https://dev.gentoo.org/~juippis/distfiles/tmp/vmd-1.9.4-gentoo-plugins.patch
 _eclasses_=cuda	c2f1b334711bbbf2130f339636dc7515	desktop	7fd20552ce4cc97e8acb132a499a7dd8	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	prefix	c2993e4c430c1ee24f278983d6189501	python-single-r1	d3100de905f978df912135806cf27188	python-utils-r1	e41e32d357e5bdd388b5be2ce24f3883	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg	c7ba313ea1eaf266f95cc6235f7d6a07	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
-_md5_=b8977005d07546a65d407f1eec48adcf
+_md5_=b92014af9861c90f488800870f57fd8e
diff --git a/metadata/md5-cache/sci-chemistry/votca-csg-1.6.3 b/metadata/md5-cache/sci-chemistry/votca-csg-1.6.3
new file mode 100644
index 000000000000..dc64c7e70743
--- /dev/null
+++ b/metadata/md5-cache/sci-chemistry/votca-csg-1.6.3
@@ -0,0 +1,15 @@
+BDEPEND=dev-util/ninja dev-util/cmake
+DEFINED_PHASES=compile configure install postinst prepare test unpack
+DEPEND=~sci-libs/votca-tools-1.6.3 >=dev-cpp/eigen-3.3 gromacs? ( sci-chemistry/gromacs:= ) hdf5? ( sci-libs/hdf5 ) dev-lang/perl app-shells/bash:* >=app-text/txt2tags-2.5 virtual/pkgconfig
+DESCRIPTION=Votca coarse-graining engine
+EAPI=7
+HOMEPAGE=http://www.votca.org
+IUSE=doc examples extras +gromacs hdf5
+KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-macos
+LICENSE=Apache-2.0
+PDEPEND=extras? ( ~sci-chemistry/votca-csgapps-1.6.3 )
+RDEPEND=~sci-libs/votca-tools-1.6.3 >=dev-cpp/eigen-3.3 gromacs? ( sci-chemistry/gromacs:= ) hdf5? ( sci-libs/hdf5 ) dev-lang/perl app-shells/bash:*
+SLOT=0
+SRC_URI=https://github.com/votca/csg/archive/v1.6.3.tar.gz -> votca-csg-1.6.3.tar.gz doc? ( https://github.com/votca/csg-manual/releases/download/v1.6.3/votca-csg-manual-1.6.3.pdf ) examples? ( https://github.com/votca/csg-tutorials/archive/v1.6.3.tar.gz -> votca-csg-tutorials-1.6.3.tar.gz )
+_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_md5_=6835c642dea08e270c6ef920ad8524f6
diff --git a/metadata/md5-cache/sci-chemistry/votca-csgapps-1.6.3 b/metadata/md5-cache/sci-chemistry/votca-csgapps-1.6.3
new file mode 100644
index 000000000000..b3764f51febe
--- /dev/null
+++ b/metadata/md5-cache/sci-chemistry/votca-csgapps-1.6.3
@@ -0,0 +1,13 @@
+BDEPEND=dev-util/ninja dev-util/cmake
+DEFINED_PHASES=compile configure install prepare test
+DEPEND=>=dev-cpp/eigen-3.3 ~sci-chemistry/votca-csg-1.6.3
+DESCRIPTION=Extra applications for votca-csg
+EAPI=7
+HOMEPAGE=http://www.votca.org
+KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-macos
+LICENSE=Apache-2.0
+RDEPEND=>=dev-cpp/eigen-3.3 ~sci-chemistry/votca-csg-1.6.3
+SLOT=0
+SRC_URI=https://github.com/votca/csgapps/archive/v1.6.3.tar.gz -> votca-csgapps-1.6.3.tar.gz
+_eclasses_=cmake	ac7cb516f6a288b6a82bc0649ce49878	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_md5_=f8d9205590ce5436d58c805fbb8a531a
diff --git a/metadata/md5-cache/sci-chemistry/votca-xtp-1.6.3 b/metadata/md5-cache/sci-chemistry/votca-xtp-1.6.3
new file mode 100644
index 000000000000..8e95076cacb2
--- /dev/null
+++ b/metadata/md5-cache/sci-chemistry/votca-xtp-1.6.3
@@ -0,0 +1,13 @@
+BDEPEND=dev-util/ninja dev-util/cmake
+DEFINED_PHASES=compile configure install postinst prepare test
+DEPEND=~sci-libs/votca-tools-1.6.3 >=dev-cpp/eigen-3.3 sci-libs/hdf5[cxx] ~sci-chemistry/votca-csg-1.6.3 sci-libs/libxc virtual/pkgconfig
+DESCRIPTION=Votca excitation and charge properties module
+EAPI=7
+HOMEPAGE=http://www.votca.org
+KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-macos
+LICENSE=Apache-2.0
+RDEPEND=~sci-libs/votca-tools-1.6.3 >=dev-cpp/eigen-3.3 sci-libs/hdf5[cxx] ~sci-chemistry/votca-csg-1.6.3 sci-libs/libxc
+SLOT=0
+SRC_URI=https://github.com/votca/xtp/archive/v1.6.3.tar.gz -> votca-xtp-1.6.3.tar.gz
+_eclasses_=bash-completion-r1	e5f9c3faab3ab3d1e7e007daa8c736ef	cmake	ac7cb516f6a288b6a82bc0649ce49878	edos2unix	33e347e171066657f91f8b0c72ec8773	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	multilib	d410501a125f99ffb560b0c523cd3d1e	multiprocessing	cac3169468f893670dac3e7cb940e045	ninja-utils	132cbb376048d079b5a012f5467c4e7f	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	wrapper	4251d4c84c25f59094fd557e0063a974	xdg-utils	ff2ff954e6b17929574eee4efc5152ba
+_md5_=dba7a732311723dfdfe2ae68dc03ea32
diff --git a/metadata/md5-cache/sci-chemistry/wxmacmolplt-7.5-r1 b/metadata/md5-cache/sci-chemistry/wxmacmolplt-7.5-r1
index 1f5750f3f049..9b9dff0854a1 100644
--- a/metadata/md5-cache/sci-chemistry/wxmacmolplt-7.5-r1
+++ b/metadata/md5-cache/sci-chemistry/wxmacmolplt-7.5-r1
@@ -8,5 +8,5 @@ LICENSE=GPL-2
 RDEPEND=media-libs/glew:0= media-libs/mesa[X(+)] x11-libs/wxGTK:3.0[X,opengl]
 SLOT=0
 SRC_URI=https://wxmacmolplt.googlecode.com/files/wxmacmolplt-7.5.tar.gz
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+_eclasses_=autotools	3ec5e49b810b2571ca9c6d76f55867bb	desktop	7fd20552ce4cc97e8acb132a499a7dd8	edos2unix	33e347e171066657f91f8b0c72ec8773	epatch	e8f1ec13660dc2f44b32775765d85e42	estack	686eaab303305a908fd57b2fd7617800	eutils	2d5b3f4b315094768576b6799e4f926e	flag-o-matic	09a8beb8e6a8e02dc1e1bd83ac353741	l10n	8cdd85e169b835d518bc2fd59f780d8e	libtool	f143db5a74ccd9ca28c1234deffede96	ltprune	4f3f2db5ce3ccbeeacdf3f94954043aa	multilib	d410501a125f99ffb560b0c523cd3d1e	preserve-libs	ef207dc62baddfddfd39a164d9797648	toolchain-funcs	605c126bed8d87e4378d5ff1645330cb	vcs-clean	2a0f74a496fa2b1552c4f3398258b7bf	wrapper	4251d4c84c25f59094fd557e0063a974	wxwidgets	e1e6e1eb5b3d911b3abd712f611e2312
 _md5_=d098e7b6812fe51a7e4b8a01f7ff5ad1