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(8.16.1/8.16.1) with ESMTP id 29G79gdM070035; Sun, 16 Oct 2022 07:09:42 GMT (envelope-from git@gitrepo.freebsd.org) Received: (from git@localhost) by gitrepo.freebsd.org (8.16.1/8.16.1/Submit) id 29G79g3V070034; Sun, 16 Oct 2022 07:09:42 GMT (envelope-from git) Date: Sun, 16 Oct 2022 07:09:42 GMT Message-Id: <202210160709.29G79g3V070034@gitrepo.freebsd.org> To: ports-committers@FreeBSD.org, dev-commits-ports-all@FreeBSD.org, dev-commits-ports-main@FreeBSD.org From: Yuri Victorovich Subject: git: 0e793c131a97 - main - science/{,py-}avogadrolibs: Update 1.95.1 -> 1.97.0 List-Id: Commits to the main branch of the FreeBSD ports repository List-Archive: https://lists.freebsd.org/archives/dev-commits-ports-main List-Help: List-Post: List-Subscribe: List-Unsubscribe: Sender: owner-dev-commits-ports-main@freebsd.org X-BeenThere: dev-commits-ports-main@freebsd.org MIME-Version: 1.0 Content-Type: text/plain; charset=utf-8 Content-Transfer-Encoding: 8bit X-Git-Committer: yuri X-Git-Repository: ports X-Git-Refname: refs/heads/main X-Git-Reftype: branch X-Git-Commit: 0e793c131a9783b574c744fdcb1dfa8a0d590eec Auto-Submitted: auto-generated ARC-Message-Signature: i=1; a=rsa-sha256; c=relaxed/relaxed; d=freebsd.org; s=dkim; t=1665904182; h=from:from:reply-to:subject:subject:date:date:message-id:message-id: to:to:cc:mime-version:mime-version:content-type:content-type: content-transfer-encoding:content-transfer-encoding; bh=oFPmArD/nROIFVO3QuNfdAtlnvbKfVkPga2aJIHvXfk=; b=lXLvmklJMcEGmBxO8LW9MdkBsocHaF5CeHZKYzPm1vIU4aDcJ/hpmNBnPqpI7qi4wGZuXW S0lEwBz2hK3uVNSr9lbLplhrow829f7PigboDvOpLocrofyfd/sJ/jHXLNqSbVPDVZQOIi QhxDYsvjLe0WdYZU3yOGT8rmeRI5TvvJ9i3ey039tgQTyLj2E02PHUFaNBuUbOqHCT5TOT 9cZRa0PbUEWDzzCV+bAaCHb8S/Ko4jC0YFD4VDY7RtZ+gQhzEkw3CsahLX75YoeWNRi7JZ Lx0a/lmzymVIQjx+bNE9a8Zx0NI1THzdVMhMrwzg1OH923T7bs32Wy36bnCyfg== ARC-Seal: i=1; s=dkim; d=freebsd.org; t=1665904182; a=rsa-sha256; cv=none; b=ckEzqoDpCQlvkoWiPdwQvm98lTgSK6XuF0+yt9ndXInc0vnnFocZG9W4xhFvLJc1Mn2LWf S4muoGaDNtZN5BNURSbgh0b97Xk4ftcDV4SNe9vb+4galZG3Z5RN50JtoqyS870iby7TiC /w/CbLBi4XYwrXsNFP6Kxki7eTghhTBJ4stHW+UIaHiA26T3z8DJIIr/cLJab8NO+SQ9Ul a6MZtAIRpO3QyitBhiH4UkA1f7Ps0i8WpUOmwETSRoUz0Nx2ez/3fEW3HkppTWSJeHmP0J 6Rx5F0A5rtSa5V6zmG8GNiS1l97sIQRhd5yKWwLpaBNqzN3/YpTF2Ey101VGzg== ARC-Authentication-Results: i=1; mx1.freebsd.org; none X-ThisMailContainsUnwantedMimeParts: N The branch main has been updated by yuri: URL: https://cgit.FreeBSD.org/ports/commit/?id=0e793c131a9783b574c744fdcb1dfa8a0d590eec commit 0e793c131a9783b574c744fdcb1dfa8a0d590eec Author: Yuri Victorovich AuthorDate: 2022-10-16 07:07:24 +0000 Commit: Yuri Victorovich CommitDate: 2022-10-16 07:09:36 +0000 science/{,py-}avogadrolibs: Update 1.95.1 -> 1.97.0 --- science/avogadrolibs/Makefile | 18 ++++++++----- science/avogadrolibs/distinfo | 10 +++---- science/avogadrolibs/pkg-plist | 56 +++++++++++++++++++++++++++++++++------- science/py-avogadrolibs/Makefile | 2 +- science/py-avogadrolibs/distinfo | 6 ++--- 5 files changed, 66 insertions(+), 26 deletions(-) diff --git a/science/avogadrolibs/Makefile b/science/avogadrolibs/Makefile index 6ca97f1f378c..d7d8859067ea 100644 --- a/science/avogadrolibs/Makefile +++ b/science/avogadrolibs/Makefile @@ -1,6 +1,5 @@ PORTNAME= avogadrolibs -DISTVERSION= 1.95.1 -PORTREVISION= 3 +DISTVERSION= 1.97.0 CATEGORIES= science MAINTAINER= yuri@FreeBSD.org @@ -10,7 +9,8 @@ WWW= https://www.openchemistry.org/projects/avogadro2/ LICENSE= GPLv2 LICENSE_FILE= ${WRKSRC}/LICENSE -TEST_DEPENDS= googletest>0:devel/googletest +TEST_DEPENDS= googletest>0:devel/googletest \ + molequeue>0:misc/molequeue USES= cmake:testing compiler:c++17-lang eigen:3,build,run # eigen needs to be 'run' because it is written into cmake files USE_LDCONFIG= yes @@ -18,13 +18,13 @@ USE_LDCONFIG= yes USE_GITHUB= yes GH_ACCOUNT= OpenChemistry GH_TUPLE= OpenChemistry:molecules:b1e16c5:molecules/../molecules \ - OpenChemistry:crystals:c3e2468:crystals/../crystals + OpenChemistry:crystals:73a5bbc:crystals/../crystals CMAKE_ON= BUILD_SHARED_LIBS CMAKE_TESTING_ON= ENABLE_TESTING OPTIONS_DEFINE= HDF5 LIBARCHIVE LIBMSYM MMTF OPENGL QT5 SPGLIB VTK -OPTIONS_DEFAULT= LIBARCHIVE LIBMSYM MMTF OPENGL QT5 SPGLIB +OPTIONS_DEFAULT= LIBARCHIVE LIBMSYM OPENGL QT5 SPGLIB # MMTF OPTIONS_SUB= yes HDF5_CMAKE_BOOL= USE_HDF5 @@ -44,6 +44,7 @@ LIBMSYM_IMPLIES= QT5 # enables the 'symmetry' Qt plugin MMTF_DESC= Enable optional features using mmtf MMTF_CMAKE_BOOL= USE_MMTF MMTF_BUILD_DEPENDS= mmtf-cpp>0:science/mmtf-cpp +MMTF_BROKEN= see https://github.com/OpenChemistry/avogadrolibs/issues/1185 OPENGL_CMAKE_BOOL= USE_OPENGL OPENGL_USES= gl @@ -61,10 +62,13 @@ SPGLIB_LIB_DEPENDS= libsymspg.so:science/spglib SPGLIB_IMPLIES= QT5 # USE_SPGLIB only installs header file without USE_QT, and also installs SpaceGroup.a with USE_QT, see https://github.com/OpenChemistry/avogadrolibs/issues/610 VTK_DESC= Enable libraries that use VTK +VTK_USES= xorg +VTK_USE= QT=opengl XORG=x11 VTK_CMAKE_BOOL= USE_VTK -VTK_LIB_DEPENDS= libvtksys-8.2.so:math/vtk8 +VTK_LIB_DEPENDS= libvtksys-9.1.so:math/vtk9 \ + libfreetype.so:print/freetype2 VTK_IMPLIES= QT5 -VTK_BROKEN= Needs https://github.com/psavery/genXrdPattern, etc +VTK_BROKEN= Needs https://github.com/psavery/genXrdPattern, see https://github.com/OpenChemistry/avogadrolibs/issues/1186 post-install: @${RM} -r ${STAGEDIR}${PREFIX}/share/doc diff --git a/science/avogadrolibs/distinfo b/science/avogadrolibs/distinfo index d81d8a9fd98a..01ea7c4d5ffa 100644 --- a/science/avogadrolibs/distinfo +++ b/science/avogadrolibs/distinfo @@ -1,7 +1,7 @@ -TIMESTAMP = 1644049029 -SHA256 (OpenChemistry-avogadrolibs-1.95.1_GH0.tar.gz) = 52817eebfc0cf700e5f6c0c4455b460618ec0dd7cb4ede5d8fabc5a2d73a7816 -SIZE (OpenChemistry-avogadrolibs-1.95.1_GH0.tar.gz) = 11015910 +TIMESTAMP = 1665902523 +SHA256 (OpenChemistry-avogadrolibs-1.97.0_GH0.tar.gz) = 46641504a1808c5ff6fb7d66be48d866848203899025fd386cc6e3dd5d9ec342 +SIZE (OpenChemistry-avogadrolibs-1.97.0_GH0.tar.gz) = 11456702 SHA256 (OpenChemistry-molecules-b1e16c5_GH0.tar.gz) = 9aa48dd94022e022d2c9eb9802ba72a4bfd69c04a08a36d562bfffc7d24bf99b SIZE (OpenChemistry-molecules-b1e16c5_GH0.tar.gz) = 207309 -SHA256 (OpenChemistry-crystals-c3e2468_GH0.tar.gz) = db4ff16c3b5e6741914ae8b5e6e7b33b1f0e8b59d28916dab4e6fa9dd65fc633 -SIZE (OpenChemistry-crystals-c3e2468_GH0.tar.gz) = 151836 +SHA256 (OpenChemistry-crystals-73a5bbc_GH0.tar.gz) = f48a06bb9e4bdc1f7dbed22fe31b187b5aa490f5796f6927001228e9ced41a5e +SIZE (OpenChemistry-crystals-73a5bbc_GH0.tar.gz) = 157627 diff --git a/science/avogadrolibs/pkg-plist b/science/avogadrolibs/pkg-plist index a34e864be5aa..f10e1f0d253d 100644 --- a/science/avogadrolibs/pkg-plist +++ b/science/avogadrolibs/pkg-plist @@ -1,16 +1,21 @@ +%%VTK%%bin/genXrdPattern +include/avogadro/calc/avogadrocalcexport.h +include/avogadro/calc/chargemanager.h +include/avogadro/calc/chargemodel.h +include/avogadro/calc/defaultmodel.h include/avogadro/core/angleiterator.h include/avogadro/core/angletools.h include/avogadro/core/array.h include/avogadro/core/atom.h include/avogadro/core/atomtyper-inline.h include/avogadro/core/atomtyper.h +include/avogadro/core/atomutilities.h include/avogadro/core/avogadrocore.h include/avogadro/core/avogadrocoreexport.h %%SPGLIB%%include/avogadro/core/avospglib.h include/avogadro/core/basisset.h include/avogadro/core/bond.h include/avogadro/core/color3f.h -include/avogadro/core/connectedgroup.h include/avogadro/core/coordinateblockgenerator.h include/avogadro/core/coordinateset.h include/avogadro/core/crystaltools.h @@ -27,6 +32,7 @@ include/avogadro/core/mesh.h include/avogadro/core/molecule.h include/avogadro/core/mutex.h include/avogadro/core/nameatomtyper.h +include/avogadro/core/neighborperceiver.h include/avogadro/core/residue.h include/avogadro/core/ringperceiver.h include/avogadro/core/secondarystructure.h @@ -56,6 +62,7 @@ include/avogadro/io/mdlformat.h %%MMTF%%include/avogadro/io/mmtfformat.h include/avogadro/io/pdbformat.h include/avogadro/io/trrformat.h +include/avogadro/io/turbomoleformat.h include/avogadro/io/vaspformat.h include/avogadro/io/xyzformat.h %%QT5%%include/avogadro/molequeue/avogadromolequeueexport.h @@ -126,6 +133,7 @@ include/avogadro/quantumio/nwchemlog.h %%OPENGL%%include/avogadro/rendering/cartoongeometry.h %%OPENGL%%include/avogadro/rendering/curvegeometry.h %%OPENGL%%include/avogadro/rendering/cylindergeometry.h +%%OPENGL%%include/avogadro/rendering/dashedlinegeometry.h %%OPENGL%%include/avogadro/rendering/drawable.h %%OPENGL%%include/avogadro/rendering/geometrynode.h %%OPENGL%%include/avogadro/rendering/geometryvisitor.h @@ -151,14 +159,21 @@ include/avogadro/quantumio/nwchemlog.h %%OPENGL%%include/avogadro/rendering/visitor.h %%OPENGL%%include/avogadro/rendering/volumegeometry.h %%OPENGL%%include/avogadro/rendering/vrmlvisitor.h +%%VTK%%include/avogadro/vtk/avogadrovtkexport.h +%%VTK%%include/avogadro/vtk/vtkAvogadroActor.h +%%VTK%%include/avogadro/vtk/vtkglwidget.h +%%VTK%%include/avogadro/vtk/vtkplot.h %%QT5%%lib/avogadro2/libgwavi.a -%%QT5%%lib/avogadro2/scripts/commands/scale.py +%%QT5%%lib/avogadro2/scripts/charges/antechamber.py +%%QT5%%lib/avogadro2/scripts/charges/xtb.py %%QT5%%lib/avogadro2/scripts/formatScripts/zyx.py %%QT5%%lib/avogadro2/staticplugins/ApplyColors.a %%QT5%%lib/avogadro2/staticplugins/BallStick.a %%QT5%%lib/avogadro2/staticplugins/BondCentric.a %%QT5%%lib/avogadro2/staticplugins/Bonding.a %%QT5%%lib/avogadro2/staticplugins/Cartoons.a +%%QT5%%lib/avogadro2/staticplugins/CloseContacts.a +%%VTK%%lib/avogadro2/staticplugins/ColorOpacityMap.a %%QT5%%lib/avogadro2/staticplugins/CoordinateEditor.a %%QT5%%lib/avogadro2/staticplugins/CopyPaste.a %%QT5%%lib/avogadro2/staticplugins/Cp2kInput.a @@ -167,12 +182,14 @@ include/avogadro/quantumio/nwchemlog.h %%QT5%%lib/avogadro2/staticplugins/CustomElements.a %%QT5%%lib/avogadro2/staticplugins/Editor.a %%QT5%%lib/avogadro2/staticplugins/FetchPDB.a +%%QT5%%lib/avogadro2/staticplugins/Focus.a %%QT5%%lib/avogadro2/staticplugins/Force.a %%QT5%%lib/avogadro2/staticplugins/GamessInput.a %%QT5%%lib/avogadro2/staticplugins/Hydrogens.a %%QT5%%lib/avogadro2/staticplugins/ImportPQR.a %%QT5%%lib/avogadro2/staticplugins/InsertFragment.a %%QT5%%lib/avogadro2/staticplugins/Label.a +%%QT5%%lib/avogadro2/staticplugins/LabelEditor.a %%QT5%%lib/avogadro2/staticplugins/LammpsInput.a %%QT5%%lib/avogadro2/staticplugins/Licorice.a %%QT5%%lib/avogadro2/staticplugins/LineFormatInput.a @@ -183,16 +200,22 @@ include/avogadro/quantumio/nwchemlog.h %%QT5%%lib/avogadro2/staticplugins/MongoChem.a %%QT5%%lib/avogadro2/staticplugins/Navigator.a %%QT5%%lib/avogadro2/staticplugins/NetworkDatabases.a +%%QT5%%lib/avogadro2/staticplugins/NonCovalent.a +%%QT5%%lib/avogadro2/staticplugins/NucleicInput.a %%QT5%%lib/avogadro2/staticplugins/OpenBabel.a %%QT5%%lib/avogadro2/staticplugins/OpenMMInput.a %%QT5%%lib/avogadro2/staticplugins/OverlayAxes.a %%QT5%%lib/avogadro2/staticplugins/POVRay.a %%QT5%%lib/avogadro2/staticplugins/PlayerTool.a +%%VTK%%lib/avogadro2/staticplugins/PlotPdf.a +%%VTK%%lib/avogadro2/staticplugins/PlotRmsd.a +%%VTK%%lib/avogadro2/staticplugins/PlotXrd.a %%LIBARCHIVE%%lib/avogadro2/staticplugins/PluginDownloader.a %%QT5%%lib/avogadro2/staticplugins/PropertyTables.a %%QT5%%lib/avogadro2/staticplugins/QuantumInput.a %%QT5%%lib/avogadro2/staticplugins/ResetView.a %%QT5%%lib/avogadro2/staticplugins/SVG.a +%%QT5%%lib/avogadro2/staticplugins/ScriptCharges.a %%QT5%%lib/avogadro2/staticplugins/ScriptFileFormats.a %%QT5%%lib/avogadro2/staticplugins/Select.a %%QT5%%lib/avogadro2/staticplugins/Selection.a @@ -216,30 +239,36 @@ lib/cmake/avogadrolibs/FindEigen3.cmake lib/cmake/avogadrolibs/FindGLEW.cmake lib/cmake/avogadrolibs/FindLibArchive.cmake lib/cmake/avogadrolibs/Findlibmsym.cmake +lib/libAvogadroCalc.so +lib/libAvogadroCalc.so.1 +lib/libAvogadroCalc.so.1.97.0 lib/libAvogadroCore.so lib/libAvogadroCore.so.1 -lib/libAvogadroCore.so.1.95.1 +lib/libAvogadroCore.so.1.97.0 lib/libAvogadroIO.so lib/libAvogadroIO.so.1 -lib/libAvogadroIO.so.1.95.1 +lib/libAvogadroIO.so.1.97.0 %%QT5%%lib/libAvogadroMoleQueue.so %%QT5%%lib/libAvogadroMoleQueue.so.1 -%%QT5%%lib/libAvogadroMoleQueue.so.1.95.1 +%%QT5%%lib/libAvogadroMoleQueue.so.1.97.0 %%QT5%%lib/libAvogadroQtGui.so %%QT5%%lib/libAvogadroQtGui.so.1 -%%QT5%%lib/libAvogadroQtGui.so.1.95.1 +%%QT5%%lib/libAvogadroQtGui.so.1.97.0 %%QT5%%lib/libAvogadroQtOpenGL.so %%QT5%%lib/libAvogadroQtOpenGL.so.1 -%%QT5%%lib/libAvogadroQtOpenGL.so.1.95.1 +%%QT5%%lib/libAvogadroQtOpenGL.so.1.97.0 %%QT5%%lib/libAvogadroQtPlugins.so %%QT5%%lib/libAvogadroQtPlugins.so.1 -%%QT5%%lib/libAvogadroQtPlugins.so.1.95.1 +%%QT5%%lib/libAvogadroQtPlugins.so.1.97.0 lib/libAvogadroQuantumIO.so lib/libAvogadroQuantumIO.so.1 -lib/libAvogadroQuantumIO.so.1.95.1 +lib/libAvogadroQuantumIO.so.1.97.0 %%OPENGL%%lib/libAvogadroRendering.so %%OPENGL%%lib/libAvogadroRendering.so.1 -%%OPENGL%%lib/libAvogadroRendering.so.1.95.1 +%%OPENGL%%lib/libAvogadroRendering.so.1.97.0 +%%VTK%%lib/libAvogadroVtk.so +%%VTK%%lib/libAvogadroVtk.so.1 +%%VTK%%lib/libAvogadroVtk.so.1.97.0 %%QT5%%share/avogadro2/crystals/README.md %%QT5%%share/avogadro2/crystals/antimonides/AlSb.cif %%QT5%%share/avogadro2/crystals/antimonides/GaSb.cif @@ -260,9 +289,11 @@ lib/libAvogadroQuantumIO.so.1.95.1 %%QT5%%share/avogadro2/crystals/carbides/WC.cif %%QT5%%share/avogadro2/crystals/carbonates/CaCO3-Calcite.cif %%QT5%%share/avogadro2/crystals/carbonates/CaMgC2O6-Dolomite.cif +%%QT5%%share/avogadro2/crystals/carbonates/FeCO3-Siderte.cif %%QT5%%share/avogadro2/crystals/carbonates/Li2CO3-Zabuyelite.cif %%QT5%%share/avogadro2/crystals/carbonates/MgCO3-Magnesite.cif %%QT5%%share/avogadro2/crystals/carbonates/Na2CO3-Natrite.cif +%%QT5%%share/avogadro2/crystals/carbonates/NaHCO3-Nahcolite.cif %%QT5%%share/avogadro2/crystals/clays/Al2Si2O9H4-Dickite.cif %%QT5%%share/avogadro2/crystals/clays/Al2Si2O9H4-Kaolinite.cif %%QT5%%share/avogadro2/crystals/clays/Al2Si2O9H4-Nacrite.cif @@ -385,6 +416,7 @@ lib/libAvogadroQuantumIO.so.1.95.1 %%QT5%%share/avogadro2/crystals/halides/AgCl-Chlorargyrite.cif %%QT5%%share/avogadro2/crystals/halides/AlCl3.cif %%QT5%%share/avogadro2/crystals/halides/AlNa3F6-Cryolite.cif +%%QT5%%share/avogadro2/crystals/halides/CaCl2-Hydrophilite.cif %%QT5%%share/avogadro2/crystals/halides/CaF2-Fluorite.cif %%QT5%%share/avogadro2/crystals/halides/CdCl2.cif %%QT5%%share/avogadro2/crystals/halides/CdI2.cif @@ -395,6 +427,7 @@ lib/libAvogadroQuantumIO.so.1.95.1 %%QT5%%share/avogadro2/crystals/halides/HgCl-Calomel.cif %%QT5%%share/avogadro2/crystals/halides/KBr.cif %%QT5%%share/avogadro2/crystals/halides/KCl-Sylvite.cif +%%QT5%%share/avogadro2/crystals/halides/LiCl.cif %%QT5%%share/avogadro2/crystals/halides/NaCl-Halite.cif %%QT5%%share/avogadro2/crystals/halides/PbFCl-Matlockite.cif %%QT5%%share/avogadro2/crystals/hydrides/KH.cif @@ -427,6 +460,7 @@ lib/libAvogadroQuantumIO.so.1.95.1 %%QT5%%share/avogadro2/crystals/nitrides/GaN.cif %%QT5%%share/avogadro2/crystals/nitrides/InN.cif %%QT5%%share/avogadro2/crystals/nitrides/Si3N4-beta.cif +%%QT5%%share/avogadro2/crystals/nitrides/TiN-Osbornite.cif %%QT5%%share/avogadro2/crystals/other/(NH4)MgPO4-6(H2O)-Struvite.cif %%QT5%%share/avogadro2/crystals/other/C10H10Fe-Ferrocene.cif %%QT5%%share/avogadro2/crystals/other/Ca2C4O10H2.57-Oxalate-Whewellite.cif @@ -527,7 +561,9 @@ lib/libAvogadroQuantumIO.so.1.95.1 %%QT5%%share/avogadro2/crystals/sulfates/CaSO4-Anhydrite.cif %%QT5%%share/avogadro2/crystals/sulfates/CoSO4.cif %%QT5%%share/avogadro2/crystals/sulfates/CuSO4.cif +%%QT5%%share/avogadro2/crystals/sulfates/H4SO5.cif %%QT5%%share/avogadro2/crystals/sulfates/MgSO4.cif +%%QT5%%share/avogadro2/crystals/sulfates/Na2SO4.cif %%QT5%%share/avogadro2/crystals/sulfates/PbSO4-Anglesite.cif %%QT5%%share/avogadro2/crystals/sulfates/SrSO4-Celestine.cif %%QT5%%share/avogadro2/crystals/sulfides/Bi2S3-Bismuthinite.cif diff --git a/science/py-avogadrolibs/Makefile b/science/py-avogadrolibs/Makefile index 2c8b2f8e1750..3e6de7923e53 100644 --- a/science/py-avogadrolibs/Makefile +++ b/science/py-avogadrolibs/Makefile @@ -1,5 +1,5 @@ PORTNAME= avogadrolibs -DISTVERSION= 1.95.1 +DISTVERSION= 1.97.0 CATEGORIES= science PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX} diff --git a/science/py-avogadrolibs/distinfo b/science/py-avogadrolibs/distinfo index 07415b0eabc4..c339169fe1e1 100644 --- a/science/py-avogadrolibs/distinfo +++ b/science/py-avogadrolibs/distinfo @@ -1,3 +1,3 @@ -TIMESTAMP = 1644050284 -SHA256 (OpenChemistry-avogadrolibs-1.95.1_GH0.tar.gz) = 52817eebfc0cf700e5f6c0c4455b460618ec0dd7cb4ede5d8fabc5a2d73a7816 -SIZE (OpenChemistry-avogadrolibs-1.95.1_GH0.tar.gz) = 11015910 +TIMESTAMP = 1665903668 +SHA256 (OpenChemistry-avogadrolibs-1.97.0_GH0.tar.gz) = 46641504a1808c5ff6fb7d66be48d866848203899025fd386cc6e3dd5d9ec342 +SIZE (OpenChemistry-avogadrolibs-1.97.0_GH0.tar.gz) = 11456702