summaryrefslogtreecommitdiff
path: root/metadata/md5-cache/sci-chemistry
diff options
context:
space:
mode:
authorV3n3RiX <venerix@koprulu.sector>2022-04-16 13:07:24 +0100
committerV3n3RiX <venerix@koprulu.sector>2022-04-16 13:07:24 +0100
commit0c100b7dd2b30e75b799d806df4ef899fd98e1ea (patch)
tree464c922e949c7e4d5d891fb2cdda5daee5612537 /metadata/md5-cache/sci-chemistry
parente68d405c5d712af4387159df07e226217bdda049 (diff)
gentoo resync : 16.04.2022
Diffstat (limited to 'metadata/md5-cache/sci-chemistry')
-rw-r--r--metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.0-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/MDAnalysis-1.0.02
-rw-r--r--metadata/md5-cache/sci-chemistry/MDAnalysis-2.0.02
-rw-r--r--metadata/md5-cache/sci-chemistry/Manifest.gzbin14043 -> 14028 bytes
-rw-r--r--metadata/md5-cache/sci-chemistry/ParmEd-3.4.34
-rw-r--r--metadata/md5-cache/sci-chemistry/autodock-4.2.64
-rw-r--r--metadata/md5-cache/sci-chemistry/chemex-2021.4.0_p64
-rw-r--r--metadata/md5-cache/sci-chemistry/chemical-mime-data-0.1.94-r44
-rw-r--r--metadata/md5-cache/sci-chemistry/chemtool-1.6.144
-rw-r--r--metadata/md5-cache/sci-chemistry/dssp-3.0.114
-rw-r--r--metadata/md5-cache/sci-chemistry/gelemental-2.0.0-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17_p6-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2020.4-r12
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2020.72
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2021.3-r12
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2021.52
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2021.99992
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-20222
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-2022.99992
-rw-r--r--metadata/md5-cache/sci-chemistry/gromacs-99992
-rw-r--r--metadata/md5-cache/sci-chemistry/mdtraj-1.9.44
-rw-r--r--metadata/md5-cache/sci-chemistry/mdtraj-1.9.74
-rw-r--r--metadata/md5-cache/sci-chemistry/modeller-9.2512
-rw-r--r--metadata/md5-cache/sci-chemistry/mopac7-1.15-r14
-rw-r--r--metadata/md5-cache/sci-chemistry/mpqc-2.3.1-r44
-rw-r--r--metadata/md5-cache/sci-chemistry/nmrglue-0.72
-rw-r--r--metadata/md5-cache/sci-chemistry/numbat-0.999-r24
-rw-r--r--metadata/md5-cache/sci-chemistry/propka-3.2.02
-rw-r--r--metadata/md5-cache/sci-chemistry/psi-3.4.0-r24
-rw-r--r--metadata/md5-cache/sci-chemistry/pymol-2.5.014
-rw-r--r--metadata/md5-cache/sci-chemistry/tinker-8.2.12
-rw-r--r--metadata/md5-cache/sci-chemistry/wxmacmolplt-7.5-r14
32 files changed, 58 insertions, 58 deletions
diff --git a/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.0-r1 b/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.0-r1
index b0ac241c5a11..13721e138e5a 100644
--- a/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.0-r1
+++ b/metadata/md5-cache/sci-chemistry/GromacsWrapper-0.8.0-r1
@@ -1,4 +1,4 @@
-BDEPEND=dev-python/six[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/numkit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] test? ( >=dev-python/pandas-0.17[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) test? ( dev-python/six[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/numkit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/pytest-6.2.5-r2[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 ) >=dev-python/setuptools-42.0.2[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?]
+BDEPEND=dev-python/six[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/numkit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] test? ( >=dev-python/pandas-0.17[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) test? ( dev-python/six[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/matplotlib[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/numkit[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/pytest-7.0.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 ) >=dev-python/setuptools-42.0.2[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?]
DEFINED_PHASES=compile configure install prepare test unpack
DESCRIPTION=Python framework for Gromacs
EAPI=7
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targe
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 e91901adfcf0640d2daa4dc863ff5377 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 vcs-snapshot 19dc666868420457132a7514d4621476
+_eclasses_=distutils-r1 779bc733c68a72273cfce64602bada1d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 vcs-snapshot 19dc666868420457132a7514d4621476
_md5_=488ae7cbcc578e8701d473e8f3cc3bfe
diff --git a/metadata/md5-cache/sci-chemistry/MDAnalysis-1.0.0 b/metadata/md5-cache/sci-chemistry/MDAnalysis-1.0.0
index d86b26184f2e..04d720815dfc 100644
--- a/metadata/md5-cache/sci-chemistry/MDAnalysis-1.0.0
+++ b/metadata/md5-cache/sci-chemistry/MDAnalysis-1.0.0
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targe
RESTRICT=!test? ( test )
SLOT=0
SRC_URI=mirror://pypi/M/MDAnalysis/MDAnalysis-1.0.0.tar.gz
-_eclasses_=distutils-r1 e91901adfcf0640d2daa4dc863ff5377 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=distutils-r1 779bc733c68a72273cfce64602bada1d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=e07b9d991b0ebdc5253eec932ecf80ed
diff --git a/metadata/md5-cache/sci-chemistry/MDAnalysis-2.0.0 b/metadata/md5-cache/sci-chemistry/MDAnalysis-2.0.0
index 0dbceae4c583..fef02de072b8 100644
--- a/metadata/md5-cache/sci-chemistry/MDAnalysis-2.0.0
+++ b/metadata/md5-cache/sci-chemistry/MDAnalysis-2.0.0
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targe
RESTRICT=test !test? ( test )
SLOT=0
SRC_URI=mirror://pypi/M/MDAnalysis/MDAnalysis-2.0.0.tar.gz
-_eclasses_=distutils-r1 e91901adfcf0640d2daa4dc863ff5377 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=distutils-r1 779bc733c68a72273cfce64602bada1d multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=ee1c9d9dd59c78af672cdcd2522e7f83
diff --git a/metadata/md5-cache/sci-chemistry/Manifest.gz b/metadata/md5-cache/sci-chemistry/Manifest.gz
index 94b3ebfbca60..153f6f01a827 100644
--- a/metadata/md5-cache/sci-chemistry/Manifest.gz
+++ b/metadata/md5-cache/sci-chemistry/Manifest.gz
Binary files differ
diff --git a/metadata/md5-cache/sci-chemistry/ParmEd-3.4.3 b/metadata/md5-cache/sci-chemistry/ParmEd-3.4.3
index 6f09e04fad73..01bd75f84121 100644
--- a/metadata/md5-cache/sci-chemistry/ParmEd-3.4.3
+++ b/metadata/md5-cache/sci-chemistry/ParmEd-3.4.3
@@ -1,4 +1,4 @@
-BDEPEND=test? ( >=dev-python/pytest-6.2.5-r2[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 ) >=dev-python/setuptools-42.0.2[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?]
+BDEPEND=test? ( >=dev-python/pytest-7.0.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 ) >=dev-python/setuptools-42.0.2[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?]
DEFINED_PHASES=compile configure install prepare test
DESCRIPTION=Parameter and topology file editor and molecular mechanical simulator engine
EAPI=8
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targe
RESTRICT=!test? ( test )
SLOT=0
SRC_URI=https://github.com/ParmEd/ParmEd/archive/refs/tags/3.4.3.tar.gz -> ParmEd-3.4.3.tar.gz
-_eclasses_=distutils-r1 e91901adfcf0640d2daa4dc863ff5377 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=distutils-r1 779bc733c68a72273cfce64602bada1d multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=77692821f30ef48205d108cdfb1a6b77
diff --git a/metadata/md5-cache/sci-chemistry/autodock-4.2.6 b/metadata/md5-cache/sci-chemistry/autodock-4.2.6
index b9d80a729fb3..0037d7536228 100644
--- a/metadata/md5-cache/sci-chemistry/autodock-4.2.6
+++ b/metadata/md5-cache/sci-chemistry/autodock-4.2.6
@@ -1,4 +1,4 @@
-BDEPEND=sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
+BDEPEND=sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
DEFINED_PHASES=compile configure install postinst prepare
DESCRIPTION=A suite of automated docking tools
EAPI=7
@@ -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 ed3ef2014ee93d24bde80f0c0ea9732e gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=d7668bb3320103bf68b0e5508795e623
diff --git a/metadata/md5-cache/sci-chemistry/chemex-2021.4.0_p6 b/metadata/md5-cache/sci-chemistry/chemex-2021.4.0_p6
index 38be69a54e12..8aa8260d71f2 100644
--- a/metadata/md5-cache/sci-chemistry/chemex-2021.4.0_p6
+++ b/metadata/md5-cache/sci-chemistry/chemex-2021.4.0_p6
@@ -1,4 +1,4 @@
-BDEPEND=test? ( python_single_target_python3_8? ( >=dev-python/asteval-0.9.25[python_targets_python3_8(-)] >=dev-python/jsonschema-4.1.0[python_targets_python3_8(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_8(-)] >=dev-python/matplotlib-3.4.3[python_targets_python3_8(-)] >=dev-python/numpy-1.21.2[python_targets_python3_8(-)] dev-python/setuptools_scm[python_targets_python3_8(-)] >=dev-python/scipy-1.7.0[python_targets_python3_8(-)] >=dev-python/tomlkit-0.7.2[python_targets_python3_8(-)] >=dev-python/tqdm-4.61.1[python_targets_python3_8(-)] ) python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/jsonschema-4.1.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.4.3[python_targets_python3_9(-)] >=dev-python/numpy-1.21.2[python_targets_python3_9(-)] dev-python/setuptools_scm[python_targets_python3_9(-)] >=dev-python/scipy-1.7.0[python_targets_python3_9(-)] >=dev-python/tomlkit-0.7.2[python_targets_python3_9(-)] >=dev-python/tqdm-4.61.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/jsonschema-4.1.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.4.3[python_targets_python3_10(-)] >=dev-python/numpy-1.21.2[python_targets_python3_10(-)] dev-python/setuptools_scm[python_targets_python3_10(-)] >=dev-python/scipy-1.7.0[python_targets_python3_10(-)] >=dev-python/tomlkit-0.7.2[python_targets_python3_10(-)] >=dev-python/tqdm-4.61.1[python_targets_python3_10(-)] ) python_single_target_python3_8? ( >=dev-python/pytest-6.2.5-r2[python_targets_python3_8(-)] ) python_single_target_python3_9? ( >=dev-python/pytest-6.2.5-r2[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/pytest-6.2.5-r2[python_targets_python3_10(-)] ) ) python_single_target_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 ) python_single_target_python3_8? ( >=dev-python/pyproject2setuppy-22[python_targets_python3_8(-)] ) python_single_target_python3_9? ( >=dev-python/pyproject2setuppy-22[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/pyproject2setuppy-22[python_targets_python3_10(-)] )
+BDEPEND=test? ( python_single_target_python3_8? ( >=dev-python/asteval-0.9.25[python_targets_python3_8(-)] >=dev-python/jsonschema-4.1.0[python_targets_python3_8(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_8(-)] >=dev-python/matplotlib-3.4.3[python_targets_python3_8(-)] >=dev-python/numpy-1.21.2[python_targets_python3_8(-)] dev-python/setuptools_scm[python_targets_python3_8(-)] >=dev-python/scipy-1.7.0[python_targets_python3_8(-)] >=dev-python/tomlkit-0.7.2[python_targets_python3_8(-)] >=dev-python/tqdm-4.61.1[python_targets_python3_8(-)] ) python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/jsonschema-4.1.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.4.3[python_targets_python3_9(-)] >=dev-python/numpy-1.21.2[python_targets_python3_9(-)] dev-python/setuptools_scm[python_targets_python3_9(-)] >=dev-python/scipy-1.7.0[python_targets_python3_9(-)] >=dev-python/tomlkit-0.7.2[python_targets_python3_9(-)] >=dev-python/tqdm-4.61.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/jsonschema-4.1.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.4.3[python_targets_python3_10(-)] >=dev-python/numpy-1.21.2[python_targets_python3_10(-)] dev-python/setuptools_scm[python_targets_python3_10(-)] >=dev-python/scipy-1.7.0[python_targets_python3_10(-)] >=dev-python/tomlkit-0.7.2[python_targets_python3_10(-)] >=dev-python/tqdm-4.61.1[python_targets_python3_10(-)] ) python_single_target_python3_8? ( >=dev-python/pytest-7.0.1[python_targets_python3_8(-)] ) python_single_target_python3_9? ( >=dev-python/pytest-7.0.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/pytest-7.0.1[python_targets_python3_10(-)] ) ) python_single_target_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_single_target_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_single_target_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 ) python_single_target_python3_8? ( >=dev-python/pyproject2setuppy-22[python_targets_python3_8(-)] ) python_single_target_python3_9? ( >=dev-python/pyproject2setuppy-22[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/pyproject2setuppy-22[python_targets_python3_10(-)] )
DEFINED_PHASES=compile configure install prepare setup test
DEPEND=python_single_target_python3_8? ( >=dev-python/asteval-0.9.25[python_targets_python3_8(-)] >=dev-python/jsonschema-4.1.0[python_targets_python3_8(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_8(-)] >=dev-python/matplotlib-3.4.3[python_targets_python3_8(-)] >=dev-python/numpy-1.21.2[python_targets_python3_8(-)] dev-python/setuptools_scm[python_targets_python3_8(-)] >=dev-python/scipy-1.7.0[python_targets_python3_8(-)] >=dev-python/tomlkit-0.7.2[python_targets_python3_8(-)] >=dev-python/tqdm-4.61.1[python_targets_python3_8(-)] ) python_single_target_python3_9? ( >=dev-python/asteval-0.9.25[python_targets_python3_9(-)] >=dev-python/jsonschema-4.1.0[python_targets_python3_9(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_9(-)] >=dev-python/matplotlib-3.4.3[python_targets_python3_9(-)] >=dev-python/numpy-1.21.2[python_targets_python3_9(-)] dev-python/setuptools_scm[python_targets_python3_9(-)] >=dev-python/scipy-1.7.0[python_targets_python3_9(-)] >=dev-python/tomlkit-0.7.2[python_targets_python3_9(-)] >=dev-python/tqdm-4.61.1[python_targets_python3_9(-)] ) python_single_target_python3_10? ( >=dev-python/asteval-0.9.25[python_targets_python3_10(-)] >=dev-python/jsonschema-4.1.0[python_targets_python3_10(-)] >=dev-python/lmfit-1.0.3[python_targets_python3_10(-)] >=dev-python/matplotlib-3.4.3[python_targets_python3_10(-)] >=dev-python/numpy-1.21.2[python_targets_python3_10(-)] dev-python/setuptools_scm[python_targets_python3_10(-)] >=dev-python/scipy-1.7.0[python_targets_python3_10(-)] >=dev-python/tomlkit-0.7.2[python_targets_python3_10(-)] >=dev-python/tqdm-4.61.1[python_targets_python3_10(-)] )
DESCRIPTION=Program to fit chemical exchange induced shift and relaxation data
@@ -12,5 +12,5 @@ REQUIRED_USE=^^ ( python_single_target_python3_8 python_single_target_python3_9
RESTRICT=test !test? ( test )
SLOT=0
SRC_URI=https://github.com/gbouvignies/chemex/archive/2021.4.0-dev6.tar.gz -> chemex-2021.4.0_p6.tar.gz
-_eclasses_=distutils-r1 e91901adfcf0640d2daa4dc863ff5377 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=distutils-r1 779bc733c68a72273cfce64602bada1d multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=e88fafb6cccdbbff67212d6d8600b15b
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 b5c188948c81..d8b0b5185c13 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
@@ -1,4 +1,4 @@
-BDEPEND=dev-util/intltool dev-util/desktop-file-utils dev-libs/libxslt || ( gnome-base/librsvg media-gfx/imagemagick[xml,png,svg] ) media-gfx/imagemagick[png] virtual/pkgconfig sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
+BDEPEND=dev-util/intltool dev-util/desktop-file-utils dev-libs/libxslt || ( gnome-base/librsvg media-gfx/imagemagick[xml,png,svg] ) media-gfx/imagemagick[png] virtual/pkgconfig sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
DEFINED_PHASES=configure postinst postrm preinst prepare
DEPEND=x11-misc/shared-mime-info dev-util/desktop-file-utils x11-misc/shared-mime-info
DESCRIPTION=A collection of data files to add support for chemical MIME types
@@ -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 ed3ef2014ee93d24bde80f0c0ea9732e gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg 6024fbc93167fad782e2032933654857 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg 6024fbc93167fad782e2032933654857 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_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 21520400c3d9..16a2bddd2fee 100644
--- a/metadata/md5-cache/sci-chemistry/chemtool-1.6.14
+++ b/metadata/md5-cache/sci-chemistry/chemtool-1.6.14
@@ -1,4 +1,4 @@
-BDEPEND=virtual/pkgconfig sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
+BDEPEND=virtual/pkgconfig sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
DEFINED_PHASES=configure install prepare
DEPEND=dev-libs/glib:2 media-gfx/transfig x11-libs/gtk+:2 x11-libs/libX11 x11-libs/pango emf? ( media-libs/libemf )
DESCRIPTION=A GTK program for drawing organic molecules
@@ -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 ed3ef2014ee93d24bde80f0c0ea9732e desktop c0d27bf73aa08ca05b663dbd31fbef28 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 desktop c0d27bf73aa08ca05b663dbd31fbef28 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=ec2a33e3b596e37ff37f7d67c3756378
diff --git a/metadata/md5-cache/sci-chemistry/dssp-3.0.11 b/metadata/md5-cache/sci-chemistry/dssp-3.0.11
index 9350b450fc1c..07bd7bdf5202 100644
--- a/metadata/md5-cache/sci-chemistry/dssp-3.0.11
+++ b/metadata/md5-cache/sci-chemistry/dssp-3.0.11
@@ -1,4 +1,4 @@
-BDEPEND=sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
+BDEPEND=sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
DEFINED_PHASES=install prepare
DEPEND=dev-lang/perl:= dev-libs/boost:=[bzip2,zlib,threads(+)]
DESCRIPTION=The protein secondary structure standard
@@ -10,5 +10,5 @@ RDEPEND=dev-lang/perl:= dev-libs/boost:=[bzip2,zlib,threads(+)]
RESTRICT=test
SLOT=0
SRC_URI=https://github.com/cmbi/hssp/archive/refs/tags/3.0.11.tar.gz -> dssp-3.0.11.tar.gz
-_eclasses_=autotools ed3ef2014ee93d24bde80f0c0ea9732e gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=071f40b480ad765fe47bc4f558fd2362
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 787ad419b584..4872d393cf9f 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-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
+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-2.71 >=sys-devel/libtool-2.4
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
@@ -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 ed3ef2014ee93d24bde80f0c0ea9732e edos2unix 33e347e171066657f91f8b0c72ec8773 eutils dab5d8ec471d025b79c9e6906bcf3bff flag-o-matic a500d7cc40da3de38c361e889153bdf7 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg 6024fbc93167fad782e2032933654857 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils dab5d8ec471d025b79c9e6906bcf3bff flag-o-matic a500d7cc40da3de38c361e889153bdf7 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg 6024fbc93167fad782e2032933654857 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_md5_=716664ceafa23c14a74889a015499733
diff --git a/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17_p6-r1 b/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17_p6-r1
index 828500582c91..ca5ee5aa59c4 100644
--- a/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17_p6-r1
+++ b/metadata/md5-cache/sci-chemistry/gnome-chemistry-utils-0.14.17_p6-r1
@@ -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-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
+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-2.71 >=sys-devel/libtool-2.4
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 >=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
@@ -10,5 +10,5 @@ LICENSE=GPL-3
RDEPEND=>=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 virtual/glu 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 mirror://debian/pool/main/g/gnome-chemistry-utils/gnome-chemistry-utils_0.14.17-6.debian.tar.xz
-_eclasses_=autotools ed3ef2014ee93d24bde80f0c0ea9732e flag-o-matic a500d7cc40da3de38c361e889153bdf7 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg 6024fbc93167fad782e2032933654857 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 flag-o-matic a500d7cc40da3de38c361e889153bdf7 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg 6024fbc93167fad782e2032933654857 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_md5_=770de380949ddaa796a1987950af22ea
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2020.4-r1 b/metadata/md5-cache/sci-chemistry/gromacs-2020.4-r1
index 8845af2d23f9..4cba16f07921 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2020.4-r1
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2020.4-r1
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cud
RESTRICT=!test? ( test )
SLOT=0/2020.4
SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2020.4.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2020.4.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2020.4.tar.gz )
-_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 e91901adfcf0640d2daa4dc863ff5377 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils dab5d8ec471d025b79c9e6906bcf3bff flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 779bc733c68a72273cfce64602bada1d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils dab5d8ec471d025b79c9e6906bcf3bff flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_md5_=bd0df586be77f14e14d10dc11d5de341
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2020.7 b/metadata/md5-cache/sci-chemistry/gromacs-2020.7
index d4a5b73e6af7..aa4207cfaf45 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2020.7
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2020.7
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cud
RESTRICT=!test? ( test )
SLOT=0/2020.7
SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2020.7.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2020.7.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2020.7.tar.gz )
-_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 e91901adfcf0640d2daa4dc863ff5377 flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 779bc733c68a72273cfce64602bada1d flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_md5_=1a99a89a7a55135d7defec7244745bf8
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021.3-r1 b/metadata/md5-cache/sci-chemistry/gromacs-2021.3-r1
index bc64749405b9..8c0dbad0ce43 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2021.3-r1
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2021.3-r1
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cud
RESTRICT=!test? ( test )
SLOT=0/2021.3
SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2021.3.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2021.3.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2021.3.tar.gz )
-_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 e91901adfcf0640d2daa4dc863ff5377 flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 779bc733c68a72273cfce64602bada1d flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_md5_=4613df6759dd93dca329c398cd3bb902
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021.5 b/metadata/md5-cache/sci-chemistry/gromacs-2021.5
index 783c1d8cbf7f..3dd0791faabb 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2021.5
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2021.5
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cud
RESTRICT=!test? ( test )
SLOT=0/2021.5
SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2021.5.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2021.5.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2021.5.tar.gz )
-_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 e91901adfcf0640d2daa4dc863ff5377 flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 779bc733c68a72273cfce64602bada1d flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_md5_=b238e533403cc41b4a1e79be7dc32aea
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2021.9999 b/metadata/md5-cache/sci-chemistry/gromacs-2021.9999
index 51acf7a5301f..2d349a6de5eb 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 ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 )
RESTRICT=!test? ( test )
SLOT=0/2021.9999
-_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 e91901adfcf0640d2daa4dc863ff5377 flag-o-matic a500d7cc40da3de38c361e889153bdf7 git-r3 b9ac6f96d2a88edb5b351df634dc5e53 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 779bc733c68a72273cfce64602bada1d flag-o-matic a500d7cc40da3de38c361e889153bdf7 git-r3 b9ac6f96d2a88edb5b351df634dc5e53 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_md5_=891a260cb91f38989ae8a55d229be10b
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2022 b/metadata/md5-cache/sci-chemistry/gromacs-2022
index 5cc18c8cd000..b506b989487f 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2022
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2022
@@ -11,5 +11,5 @@ REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cud
RESTRICT=!test? ( test )
SLOT=0/2022
SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2022.tar.gz doc? ( https://ftp.gromacs.org/manual/manual-2022.pdf ) test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2022.tar.gz )
-_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 e91901adfcf0640d2daa4dc863ff5377 flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 779bc733c68a72273cfce64602bada1d flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_md5_=b1a6a2c64a9f74fce4b3caf895b7a069
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-2022.9999 b/metadata/md5-cache/sci-chemistry/gromacs-2022.9999
index 77b95bc4b378..64ef75ccc04c 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-2022.9999
+++ b/metadata/md5-cache/sci-chemistry/gromacs-2022.9999
@@ -10,5 +10,5 @@ RDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profile
REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 )
RESTRICT=!test? ( test )
SLOT=0/2022.9999
-_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 e91901adfcf0640d2daa4dc863ff5377 flag-o-matic a500d7cc40da3de38c361e889153bdf7 git-r3 b9ac6f96d2a88edb5b351df634dc5e53 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 779bc733c68a72273cfce64602bada1d flag-o-matic a500d7cc40da3de38c361e889153bdf7 git-r3 b9ac6f96d2a88edb5b351df634dc5e53 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_md5_=411759b5d1aafba82ba53c7034547a5c
diff --git a/metadata/md5-cache/sci-chemistry/gromacs-9999 b/metadata/md5-cache/sci-chemistry/gromacs-9999
index 3958ac022f2c..7f86e236eaf2 100644
--- a/metadata/md5-cache/sci-chemistry/gromacs-9999
+++ b/metadata/md5-cache/sci-chemistry/gromacs-9999
@@ -10,5 +10,5 @@ RDEPEND=blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-11[profile
REQUIRED_USE=|| ( single-precision double-precision ) doc? ( !build-manual ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 ) ^^ ( python_single_target_python3_8 python_single_target_python3_9 python_single_target_python3_10 )
RESTRICT=!test? ( test )
SLOT=0/9999
-_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 e91901adfcf0640d2daa4dc863ff5377 flag-o-matic a500d7cc40da3de38c361e889153bdf7 git-r3 b9ac6f96d2a88edb5b351df634dc5e53 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_eclasses_=bash-completion-r1 f5e7a020fd9c741740756aac61bf75ff cmake 3c38df051095289667b6f09ebd0cc149 cuda 15edbf8fd9df209322f42c06ecf59a96 distutils-r1 779bc733c68a72273cfce64602bada1d flag-o-matic a500d7cc40da3de38c361e889153bdf7 git-r3 b9ac6f96d2a88edb5b351df634dc5e53 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b ninja-utils fef481272d4a8e136a7d8a0fb1329384 python-single-r1 a5747fe6dc0651d95cb78eddd5e160a8 python-utils-r1 59dddabd6a41ab69723654916142f63b readme.gentoo-r1 b776ad4b42f564c406a95c41ccb42c55 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
_md5_=411759b5d1aafba82ba53c7034547a5c
diff --git a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4 b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4
index 8f3f200f962b..57ec170d91f6 100644
--- a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4
+++ b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.4
@@ -1,4 +1,4 @@
-BDEPEND=test? ( dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] >=dev-python/pytest-6.2.5-r2[python_targets_python3_8(-)?,python_targets_python3_9(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) >=dev-python/setuptools-42.0.2[python_targets_python3_8(-)?,python_targets_python3_9(-)?]
+BDEPEND=test? ( dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] >=dev-python/pytest-7.0.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) >=dev-python/setuptools-42.0.2[python_targets_python3_8(-)?,python_targets_python3_9(-)?]
DEFINED_PHASES=compile configure install prepare test
DEPEND=dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] test? ( dev-python/jupyter_client[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/nbformat[python_targets_python3_8(-)?,python_targets_python3_9(-)?] )
DESCRIPTION=Read, write and analyze MD trajectories with only a few lines of Python code
@@ -12,5 +12,5 @@ REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 )
RESTRICT=test
SLOT=0
SRC_URI=mirror://pypi/m/mdtraj/mdtraj-1.9.4.tar.gz
-_eclasses_=distutils-r1 e91901adfcf0640d2daa4dc863ff5377 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=distutils-r1 779bc733c68a72273cfce64602bada1d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=dbdcffa8a3d57c4db3c130a0096698ea
diff --git a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.7 b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.7
index 69d98147ba55..9e0249e54d89 100644
--- a/metadata/md5-cache/sci-chemistry/mdtraj-1.9.7
+++ b/metadata/md5-cache/sci-chemistry/mdtraj-1.9.7
@@ -1,4 +1,4 @@
-BDEPEND=test? ( dev-python/astunparse[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pyparsing[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/pytest-6.2.5-r2[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 ) >=dev-python/setuptools-42.0.2[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?]
+BDEPEND=test? ( dev-python/astunparse[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pyparsing[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] >=dev-python/pytest-7.0.1[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] ) python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 ) >=dev-python/setuptools-42.0.2[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?]
DEFINED_PHASES=compile configure install prepare test
DEPEND=dev-python/astunparse[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/astor[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pandas[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pytables[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pyparsing[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/networkx[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/scipy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] test? ( dev-python/ipykernel[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/jupyter_client[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/nbformat[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] sci-libs/scikit-learn[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] )
DESCRIPTION=Read, write and analyze MD trajectories with only a few lines of Python code
@@ -12,5 +12,5 @@ REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targe
RESTRICT=!test? ( test )
SLOT=0
SRC_URI=mirror://pypi/m/mdtraj/mdtraj-1.9.7.tar.gz
-_eclasses_=distutils-r1 e91901adfcf0640d2daa4dc863ff5377 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=distutils-r1 779bc733c68a72273cfce64602bada1d multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=34e3e44700bff65c157b4746eba8555a
diff --git a/metadata/md5-cache/sci-chemistry/modeller-9.25 b/metadata/md5-cache/sci-chemistry/modeller-9.25
index cb20ca2bcab4..8c4bbef5f196 100644
--- a/metadata/md5-cache/sci-chemistry/modeller-9.25
+++ b/metadata/md5-cache/sci-chemistry/modeller-9.25
@@ -1,16 +1,16 @@
-BDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 )
+BDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 )
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_8 python_targets_python3_9
+IUSE=doc examples python_targets_python3_8 python_targets_python3_9 python_targets_python3_10
KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux
LICENSE=modeller
-RDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 )
-REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 )
+RDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 )
+REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 )
RESTRICT=mirror
SLOT=0
SRC_URI=https://salilab.org/modeller/9.25/modeller-9.25.tar.gz
-_eclasses_=distutils-r1 e91901adfcf0640d2daa4dc863ff5377 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
-_md5_=5d9975b49fae85d859bbbbd318436f17
+_eclasses_=distutils-r1 779bc733c68a72273cfce64602bada1d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_md5_=b95991329a6a5e37067102edc03fc9c6
diff --git a/metadata/md5-cache/sci-chemistry/mopac7-1.15-r1 b/metadata/md5-cache/sci-chemistry/mopac7-1.15-r1
index ee56d350dbb2..42637c5514ce 100644
--- a/metadata/md5-cache/sci-chemistry/mopac7-1.15-r1
+++ b/metadata/md5-cache/sci-chemistry/mopac7-1.15-r1
@@ -1,4 +1,4 @@
-BDEPEND=sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4 virtual/fortran
+BDEPEND=sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4 virtual/fortran
DEFINED_PHASES=compile configure install prepare setup
DEPEND=dev-libs/libf2c virtual/fortran
DESCRIPTION=Autotooled, updated version of a powerful, fast semi-empirical package
@@ -10,5 +10,5 @@ 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 ed3ef2014ee93d24bde80f0c0ea9732e flag-o-matic a500d7cc40da3de38c361e889153bdf7 fortran-2 72d28c6872beb1e7cb99684b0ae4715d gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 flag-o-matic a500d7cc40da3de38c361e889153bdf7 fortran-2 72d28c6872beb1e7cb99684b0ae4715d gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=b003c0476ccd7ad71ed1861aaad5be2e
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 87f7191c1856..92688fb4549b 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 sys-devel/flex virtual/pkgconfig doc? ( app-doc/doxygen media-gfx/graphviz ) sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
+BDEPEND=dev-lang/perl sys-devel/flex 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-2.71 >=sys-devel/libtool-2.4
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
@@ -10,5 +10,5 @@ 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 ed3ef2014ee93d24bde80f0c0ea9732e gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=eba936ba87f329464c8bcdaca1a0c1bf
diff --git a/metadata/md5-cache/sci-chemistry/nmrglue-0.7 b/metadata/md5-cache/sci-chemistry/nmrglue-0.7
index 93870e6c41ec..ccc536a01028 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_8 python_targets_python3_9 )
RESTRICT=!test? ( test )
SLOT=0
SRC_URI=https://github.com/jjhelmus/nmrglue/releases/download/v0.7/nmrglue-0.7.tar.gz
-_eclasses_=distutils-r1 e91901adfcf0640d2daa4dc863ff5377 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=distutils-r1 779bc733c68a72273cfce64602bada1d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=197459a7eef5261de4cf3cb0315254ac
diff --git a/metadata/md5-cache/sci-chemistry/numbat-0.999-r2 b/metadata/md5-cache/sci-chemistry/numbat-0.999-r2
index 19f6fc9c9a31..ef22029f603e 100644
--- a/metadata/md5-cache/sci-chemistry/numbat-0.999-r2
+++ b/metadata/md5-cache/sci-chemistry/numbat-0.999-r2
@@ -1,4 +1,4 @@
-BDEPEND=virtual/pkgconfig sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
+BDEPEND=virtual/pkgconfig sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
DEFINED_PHASES=install prepare
DEPEND=gnome-base/libglade:2.0 sci-libs/gsl:= x11-libs/gtk+:2
DESCRIPTION=New user-friendly method built for automatic dX-tensor determination
@@ -9,5 +9,5 @@ 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 ed3ef2014ee93d24bde80f0c0ea9732e gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=df1e675b0c125ce11088c4e66c658685
diff --git a/metadata/md5-cache/sci-chemistry/propka-3.2.0 b/metadata/md5-cache/sci-chemistry/propka-3.2.0
index 19c239a79df5..44f836b809ba 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_8 )
RESTRICT=!test? ( test )
SLOT=0
SRC_URI=mirror://pypi/p/propka/propka-3.2.0.tar.gz
-_eclasses_=distutils-r1 e91901adfcf0640d2daa4dc863ff5377 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=distutils-r1 779bc733c68a72273cfce64602bada1d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_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 9bdc4fc26bd8..47ff8521e36f 100644
--- a/metadata/md5-cache/sci-chemistry/psi-3.4.0-r2
+++ b/metadata/md5-cache/sci-chemistry/psi-3.4.0-r2
@@ -1,4 +1,4 @@
-BDEPEND=dev-util/byacc virtual/pkgconfig test? ( dev-lang/perl ) sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4 virtual/fortran
+BDEPEND=dev-util/byacc virtual/pkgconfig test? ( dev-lang/perl ) sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4 virtual/fortran
DEFINED_PHASES=compile configure install prepare setup test
DEPEND=!sci-visualization/extrema virtual/blas virtual/lapack >=sci-libs/libint-1.1.4:1 virtual/fortran
DESCRIPTION=Suite for ab initio quantum chemistry computing various molecular properties
@@ -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 ed3ef2014ee93d24bde80f0c0ea9732e fortran-2 72d28c6872beb1e7cb99684b0ae4715d gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 fortran-2 72d28c6872beb1e7cb99684b0ae4715d gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8
_md5_=ecd9eddd7cba15554c7599004f94761a
diff --git a/metadata/md5-cache/sci-chemistry/pymol-2.5.0 b/metadata/md5-cache/sci-chemistry/pymol-2.5.0
index 80a962abd27b..64f67e90ba7d 100644
--- a/metadata/md5-cache/sci-chemistry/pymol-2.5.0
+++ b/metadata/md5-cache/sci-chemistry/pymol-2.5.0
@@ -1,16 +1,16 @@
-BDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 )
+BDEPEND=python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 )
DEFINED_PHASES=compile configure install postinst postrm preinst prepare test
-DEPEND=dev-libs/msgpack[cxx] dev-libs/mmtf-cpp dev-python/pyopengl[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/PyQt5[opengl,python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pmw[python_targets_python3_8(-)?,python_targets_python3_9(-)?] media-libs/freetype:2 media-libs/glew:0= media-libs/glm media-libs/libpng:0= media-video/mpeg-tools sys-libs/zlib netcdf? ( sci-libs/netcdf:0= ) dev-util/desktop-file-utils x11-misc/shared-mime-info
+DEPEND=dev-libs/msgpack[cxx] dev-libs/mmtf-cpp dev-python/pyopengl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/PyQt5[opengl,python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pmw[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] media-libs/freetype:2 media-libs/glew:0= media-libs/glm media-libs/libpng:0= media-video/mpeg-tools sys-libs/zlib netcdf? ( sci-libs/netcdf:0= ) dev-util/desktop-file-utils x11-misc/shared-mime-info
DESCRIPTION=A Python-extensible molecular graphics system
EAPI=7
HOMEPAGE=https://www.pymol.org/
-IUSE=+netcdf web python_targets_python3_8 python_targets_python3_9
+IUSE=+netcdf web python_targets_python3_8 python_targets_python3_9 python_targets_python3_10
KEYWORDS=~amd64 ~x86 ~amd64-linux ~x86-linux ~x64-macos
LICENSE=PSF-2.2
-RDEPEND=dev-libs/msgpack[cxx] dev-libs/mmtf-cpp dev-python/pyopengl[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/PyQt5[opengl,python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?] dev-python/pmw[python_targets_python3_8(-)?,python_targets_python3_9(-)?] media-libs/freetype:2 media-libs/glew:0= media-libs/glm media-libs/libpng:0= media-video/mpeg-tools sys-libs/zlib netcdf? ( sci-libs/netcdf:0= ) sci-chemistry/chemical-mime-data python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 )
-REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 )
+RDEPEND=dev-libs/msgpack[cxx] dev-libs/mmtf-cpp dev-python/pyopengl[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/PyQt5[opengl,python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/numpy[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] dev-python/pmw[python_targets_python3_8(-)?,python_targets_python3_9(-)?,python_targets_python3_10(-)?] media-libs/freetype:2 media-libs/glew:0= media-libs/glm media-libs/libpng:0= media-video/mpeg-tools sys-libs/zlib netcdf? ( sci-libs/netcdf:0= ) sci-chemistry/chemical-mime-data python_targets_python3_8? ( >=dev-lang/python-3.8.12_p1-r1:3.8 ) python_targets_python3_9? ( >=dev-lang/python-3.9.9-r1:3.9 ) python_targets_python3_10? ( >=dev-lang/python-3.10.0_p1-r1:3.10 )
+REQUIRED_USE=|| ( python_targets_python3_8 python_targets_python3_9 python_targets_python3_10 )
RESTRICT=mirror
SLOT=0
SRC_URI=https://dev.gentoo.org/~pacho/pymol/pymol-1.8.4.0.png.xz https://github.com/schrodinger/pymol-open-source/archive/v2.5.0.tar.gz -> pymol-2.5.0.tar.gz
-_eclasses_=desktop c0d27bf73aa08ca05b663dbd31fbef28 distutils-r1 e91901adfcf0640d2daa4dc863ff5377 eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils dab5d8ec471d025b79c9e6906bcf3bff flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b optfeature d524f291c80f9d21ad80fe978e3ca760 python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg 6024fbc93167fad782e2032933654857 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
-_md5_=c7ffea6e164d1fd0a5649c6eb3a85da0
+_eclasses_=desktop c0d27bf73aa08ca05b663dbd31fbef28 distutils-r1 779bc733c68a72273cfce64602bada1d eapi8-dosym cd7d420bb5be5ee079f27239ce76b8f5 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils dab5d8ec471d025b79c9e6906bcf3bff flag-o-matic a500d7cc40da3de38c361e889153bdf7 multibuild d26d81f242cb193d899a72bca423d0bd multilib 4a33c9008e5ee30cb8840a3fdc24df2b multiprocessing 61c959fc55c15c00bbb1079d6a71370b python-r1 8638751691200e941f26fe0ac3aef1d1 python-utils-r1 59dddabd6a41ab69723654916142f63b strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 wrapper 4a1902f969e5718126434fc35f3a0d9c xdg 6024fbc93167fad782e2032933654857 xdg-utils fffb53a53cf17c9c0c998a3c0a590c7e
+_md5_=7bb4d93e554e41f93f1e3959c541e38c
diff --git a/metadata/md5-cache/sci-chemistry/tinker-8.2.1 b/metadata/md5-cache/sci-chemistry/tinker-8.2.1
index 836976726e37..3422eb53df25 100644
--- a/metadata/md5-cache/sci-chemistry/tinker-8.2.1
+++ b/metadata/md5-cache/sci-chemistry/tinker-8.2.1
@@ -10,5 +10,5 @@ RDEPEND=>=sci-libs/fftw-3.2.2-r1[fortran,threads] dev-libs/maloc !sys-apps/bar !
RESTRICT=mirror
SLOT=0
SRC_URI=http://dasher.wustl.edu/tinker/downloads/tinker-8.2.1.tar.gz
-_eclasses_=desktop c0d27bf73aa08ca05b663dbd31fbef28 eapi7-ver 1a0a60ad07c8b32d2faba2d085dc0f24 edos2unix 33e347e171066657f91f8b0c72ec8773 epatch 9f813bb3c47cf2e60619a663b87c5f4e estack 055c42df72f76a4f45ec92b35e83cd56 eutils dab5d8ec471d025b79c9e6906bcf3bff flag-o-matic a500d7cc40da3de38c361e889153bdf7 fortran-2 72d28c6872beb1e7cb99684b0ae4715d java-pkg-opt-2 a71433e535af8faae0c0f6c861a32054 java-utils-2 5faae27f317e090a61b74f53f5e0cbc9 ltprune 4f3f2db5ce3ccbeeacdf3f94954043aa multilib 4a33c9008e5ee30cb8840a3fdc24df2b preserve-libs a8e50acee31b5759b4df1f7707cae54b strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 vcs-clean d271b7bc7e6a009758d7d4ef749174e3 versionator d3fb3ba33acc3bbbdc4d7970227c100d wrapper 4a1902f969e5718126434fc35f3a0d9c
+_eclasses_=desktop c0d27bf73aa08ca05b663dbd31fbef28 eapi7-ver 1a0a60ad07c8b32d2faba2d085dc0f24 edos2unix 33e347e171066657f91f8b0c72ec8773 epatch 9f813bb3c47cf2e60619a663b87c5f4e estack 055c42df72f76a4f45ec92b35e83cd56 eutils dab5d8ec471d025b79c9e6906bcf3bff flag-o-matic a500d7cc40da3de38c361e889153bdf7 fortran-2 72d28c6872beb1e7cb99684b0ae4715d java-pkg-opt-2 a71433e535af8faae0c0f6c861a32054 java-utils-2 92b5a4d196abffe2dbe3bdc1cf4ef2ae ltprune 4f3f2db5ce3ccbeeacdf3f94954043aa multilib 4a33c9008e5ee30cb8840a3fdc24df2b preserve-libs a8e50acee31b5759b4df1f7707cae54b strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 vcs-clean d271b7bc7e6a009758d7d4ef749174e3 versionator d3fb3ba33acc3bbbdc4d7970227c100d wrapper 4a1902f969e5718126434fc35f3a0d9c
_md5_=fb598b8d929f5e0c789410edc0a98c00
diff --git a/metadata/md5-cache/sci-chemistry/wxmacmolplt-7.5-r1 b/metadata/md5-cache/sci-chemistry/wxmacmolplt-7.5-r1
index b3af8fb5babc..1cddfe82ecbe 100644
--- a/metadata/md5-cache/sci-chemistry/wxmacmolplt-7.5-r1
+++ b/metadata/md5-cache/sci-chemistry/wxmacmolplt-7.5-r1
@@ -1,4 +1,4 @@
-BDEPEND=virtual/pkgconfig sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.4:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
+BDEPEND=virtual/pkgconfig sys-devel/gnuconfig >=app-portage/elt-patches-20170815 || ( >=sys-devel/automake-1.16.5:1.16 ) >=sys-devel/autoconf-2.71 >=sys-devel/libtool-2.4
DEFINED_PHASES=configure install prepare
DEPEND=media-libs/glew:0= media-libs/mesa[X(+)] x11-libs/wxGTK:3.0[X,opengl]
DESCRIPTION=Chemical 3D graphics program with GAMESS input builder
@@ -9,5 +9,5 @@ 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
-_eclasses_=autotools ed3ef2014ee93d24bde80f0c0ea9732e desktop c0d27bf73aa08ca05b663dbd31fbef28 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils dab5d8ec471d025b79c9e6906bcf3bff flag-o-matic a500d7cc40da3de38c361e889153bdf7 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 wrapper 4a1902f969e5718126434fc35f3a0d9c wxwidgets c09e9b94378cadaf6ef86ec1534c0fd6
+_eclasses_=autotools 9724194ab651ce63fd9bc06e4e1410b4 desktop c0d27bf73aa08ca05b663dbd31fbef28 edos2unix 33e347e171066657f91f8b0c72ec8773 eutils dab5d8ec471d025b79c9e6906bcf3bff flag-o-matic a500d7cc40da3de38c361e889153bdf7 gnuconfig 262062cef0ba4f22b397193da514a350 libtool 241a8f577b9781a42a7421e53448a44e multilib 4a33c9008e5ee30cb8840a3fdc24df2b strip-linguas ac3ee41ee2d31d8c41a77c0838320cc7 toolchain-funcs badd6e329e1f3e6bee99b35bf8763ce8 wrapper 4a1902f969e5718126434fc35f3a0d9c wxwidgets c09e9b94378cadaf6ef86ec1534c0fd6
_md5_=79066879c49f635ae7f6925ca500e74a