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Unable to retrieve program name for "/usr/lib64/avogadro2/scripts/charges/antechamber.py" #1323

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sagitter opened this issue Aug 15, 2023 · 6 comments · Fixed by #1336
Closed

Unable to retrieve program name for "/usr/lib64/avogadro2/scripts/charges/antechamber.py" #1323

sagitter opened this issue Aug 15, 2023 · 6 comments · Fixed by #1336

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@sagitter
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sagitter commented Aug 15, 2023 •
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Hi all

Avogadro version:

Desktop version:

  • OS: Fedora
  • Version: 38
  • Compiler: GCC-13.0.1

Describe the bug
This error comes out when i execute avogadro2:

ScriptLoader::queryProgramName: Unable to retrieve program name for "/usr/lib64/avogadro2/scripts/charges/antechamber.py" ; "Error running script '/usr/bin/python3 /usr/lib64/avogadro2/scripts/charges/antechamber.py --display-name --lang en_US': Abnormal exit status 1 (Errore sconosciuto.: Unknown error)\n\nOutput:\nTraceback (most recent call last):\n  File \"/usr/lib64/avogadro2/scripts/charges/antechamber.py\", line 151, in <module>\n    raise RuntimeError(\"antechamber is unavailable\")\nRuntimeError: antechamber is unavailable\n"

To Reproduce
Steps to reproduce the behavior:

  1. Install Avogadro2 in Fedora
  2. By command line:

$ export QT_QPA_PLATFORM=wayland
or
$ export QT_QPA_PLATFORM=xcb

then

$ export LD_LIBRARY_PATH=/usr/lib64/avogadro2
$ avogadro2

Expected behavior

No error

Additional context

This issue is reported by a Fedora user: https://bugzilla.redhat.com/show_bug.cgi?id=2228144

Directories/files's tree of avogadro2-libs in Fedora 38:

[sagitter@localhost avogadro2]$ rpm -q --list avogadro2-libs
/usr/lib64/avogadro2
/usr/lib64/avogadro2/libgwavi.a
/usr/lib64/avogadro2/scripts
/usr/lib64/avogadro2/scripts/charges
/usr/lib64/avogadro2/scripts/charges/antechamber.py
/usr/lib64/avogadro2/scripts/charges/xtb.py
/usr/lib64/avogadro2/scripts/scripts
/usr/lib64/avogadro2/staticplugins
/usr/lib64/avogadro2/staticplugins/ApplyColors.a
/usr/lib64/avogadro2/staticplugins/BallStick.a
/usr/lib64/avogadro2/staticplugins/BondCentric.a
/usr/lib64/avogadro2/staticplugins/Bonding.a
/usr/lib64/avogadro2/staticplugins/Cartoons.a
/usr/lib64/avogadro2/staticplugins/CloseContacts.a
/usr/lib64/avogadro2/staticplugins/CoordinateEditor.a
/usr/lib64/avogadro2/staticplugins/CopyPaste.a
/usr/lib64/avogadro2/staticplugins/Cp2kInput.a
/usr/lib64/avogadro2/staticplugins/Crystal.a
/usr/lib64/avogadro2/staticplugins/CrystalScene.a
/usr/lib64/avogadro2/staticplugins/CustomElements.a
/usr/lib64/avogadro2/staticplugins/Editor.a
/usr/lib64/avogadro2/staticplugins/FetchPDB.a
/usr/lib64/avogadro2/staticplugins/Focus.a
/usr/lib64/avogadro2/staticplugins/Force.a
/usr/lib64/avogadro2/staticplugins/GamessInput.a
/usr/lib64/avogadro2/staticplugins/Hydrogens.a
/usr/lib64/avogadro2/staticplugins/ImportPQR.a
/usr/lib64/avogadro2/staticplugins/InsertFragment.a
/usr/lib64/avogadro2/staticplugins/Label.a
/usr/lib64/avogadro2/staticplugins/LabelEditor.a
/usr/lib64/avogadro2/staticplugins/LammpsInput.a
/usr/lib64/avogadro2/staticplugins/Licorice.a
/usr/lib64/avogadro2/staticplugins/LineFormatInput.a
/usr/lib64/avogadro2/staticplugins/Manipulator.a
/usr/lib64/avogadro2/staticplugins/MeasureTool.a
/usr/lib64/avogadro2/staticplugins/Meshes.a
/usr/lib64/avogadro2/staticplugins/MolecularProperties.a
/usr/lib64/avogadro2/staticplugins/MongoChem.a
/usr/lib64/avogadro2/staticplugins/Navigator.a
/usr/lib64/avogadro2/staticplugins/NetworkDatabases.a
/usr/lib64/avogadro2/staticplugins/NonCovalent.a
/usr/lib64/avogadro2/staticplugins/NucleicInput.a
/usr/lib64/avogadro2/staticplugins/OpenBabel.a
/usr/lib64/avogadro2/staticplugins/OpenMMInput.a
/usr/lib64/avogadro2/staticplugins/OverlayAxes.a
/usr/lib64/avogadro2/staticplugins/POVRay.a
/usr/lib64/avogadro2/staticplugins/PlayerTool.a
/usr/lib64/avogadro2/staticplugins/PluginDownloader.a
/usr/lib64/avogadro2/staticplugins/PropertyTables.a
/usr/lib64/avogadro2/staticplugins/QTAIMExtension.a
/usr/lib64/avogadro2/staticplugins/QTAIMScenePlugin.a
/usr/lib64/avogadro2/staticplugins/QuantumInput.a
/usr/lib64/avogadro2/staticplugins/ResetView.a
/usr/lib64/avogadro2/staticplugins/SVG.a
/usr/lib64/avogadro2/staticplugins/ScriptCharges.a
/usr/lib64/avogadro2/staticplugins/ScriptFileFormats.a
/usr/lib64/avogadro2/staticplugins/Select.a
/usr/lib64/avogadro2/staticplugins/Selection.a
/usr/lib64/avogadro2/staticplugins/SpaceGroup.a
/usr/lib64/avogadro2/staticplugins/Spectra.a
/usr/lib64/avogadro2/staticplugins/Surfaces.a
/usr/lib64/avogadro2/staticplugins/ThreeDMol.a
/usr/lib64/avogadro2/staticplugins/VRML.a
/usr/lib64/avogadro2/staticplugins/VanDerWaals.a
/usr/lib64/avogadro2/staticplugins/VanDerWaalsAO.a
/usr/lib64/avogadro2/staticplugins/Wireframe.a
/usr/lib64/avogadro2/staticplugins/apbs.a
/usr/lib64/avogadro2/staticplugins/commands.a
/usr/lib64/libAvogadroCalc.so.1
/usr/lib64/libAvogadroCalc.so.1.97.0
/usr/lib64/libAvogadroCore.so.1
/usr/lib64/libAvogadroCore.so.1.97.0
/usr/lib64/libAvogadroIO.so.1
/usr/lib64/libAvogadroIO.so.1.97.0
/usr/lib64/libAvogadroMoleQueue.so.1
/usr/lib64/libAvogadroMoleQueue.so.1.97.0
/usr/lib64/libAvogadroQtGui.so.1
/usr/lib64/libAvogadroQtGui.so.1.97.0
/usr/lib64/libAvogadroQtOpenGL.so.1
/usr/lib64/libAvogadroQtOpenGL.so.1.97.0
/usr/lib64/libAvogadroQtPlugins.so.1
/usr/lib64/libAvogadroQtPlugins.so.1.97.0
/usr/lib64/libAvogadroQuantumIO.so.1
/usr/lib64/libAvogadroQuantumIO.so.1.97.0
/usr/lib64/libAvogadroRendering.so.1
/usr/lib64/libAvogadroRendering.so.1.97.0
/usr/lib64/python3.11/site-packages/avogadro2
/usr/lib64/python3.11/site-packages/avogadro2/scripts
/usr/lib64/python3.11/site-packages/avogadro2/scripts/charges
/usr/lib64/python3.11/site-packages/avogadro2/scripts/charges/__pycache__
/usr/lib64/python3.11/site-packages/avogadro2/scripts/charges/__pycache__/antechamber.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/charges/__pycache__/antechamber.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/charges/__pycache__/xtb.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/charges/__pycache__/xtb.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/charges/antechamber.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/charges/xtb.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/formatScripts
/usr/lib64/python3.11/site-packages/avogadro2/scripts/formatScripts/__pycache__
/usr/lib64/python3.11/site-packages/avogadro2/scripts/formatScripts/__pycache__/zyx.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/formatScripts/__pycache__/zyx.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/formatScripts/zyx.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/dalton.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/dalton.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/gamessuk.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/gamessuk.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/gaussian.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/gaussian.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/molpro.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/molpro.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/mopac.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/mopac.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/nwchem.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/nwchem.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/orca.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/orca.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/psi4.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/psi4.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/pyscf.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/pyscf.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/qchem.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/qchem.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/terachem.cpython-311.opt-1.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/__pycache__/terachem.cpython-311.pyc
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/dalton.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/gamessuk.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/gaussian.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/molpro.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/mopac.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/nwchem.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/orca.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/psi4.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/pyscf.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/qchem.py
/usr/lib64/python3.11/site-packages/avogadro2/scripts/inputGenerators/terachem.py
/usr/share/avogadro2
/usr/share/avogadro2/crystals
/usr/share/avogadro2/crystals/README.md
/usr/share/avogadro2/crystals/antimonides
/usr/share/avogadro2/crystals/antimonides/AlSb.cif
/usr/share/avogadro2/crystals/antimonides/GaSb.cif
/usr/share/avogadro2/crystals/antimonides/InSb.cif
/usr/share/avogadro2/crystals/arsenides
/usr/share/avogadro2/crystals/arsenides/AlAs.cif
/usr/share/avogadro2/crystals/arsenides/BAs.cif
/usr/share/avogadro2/crystals/arsenides/Co.87Fe.11Ni.13As3-Skutterudite.cif
/usr/share/avogadro2/crystals/arsenides/CoAs3-Skutterudite.cif
/usr/share/avogadro2/crystals/arsenides/GaAs.cif
/usr/share/avogadro2/crystals/arsenides/InAs.cif
/usr/share/avogadro2/crystals/arsenides/NiAs-Nickeline.cif
/usr/share/avogadro2/crystals/carbides
/usr/share/avogadro2/crystals/carbides/SiC-2H-Moissanite.cif
/usr/share/avogadro2/crystals/carbides/SiC-3C-beta.cif
/usr/share/avogadro2/crystals/carbides/SiC-6H-alpha.cif
/usr/share/avogadro2/crystals/carbides/SiC-Moissanite.cif
/usr/share/avogadro2/crystals/carbides/SiC.cif
/usr/share/avogadro2/crystals/carbides/W2C.cif
/usr/share/avogadro2/crystals/carbides/WC.cif
/usr/share/avogadro2/crystals/carbonates
/usr/share/avogadro2/crystals/carbonates/CaCO3-Calcite.cif
/usr/share/avogadro2/crystals/carbonates/CaMgC2O6-Dolomite.cif
/usr/share/avogadro2/crystals/carbonates/Li2CO3-Zabuyelite.cif
/usr/share/avogadro2/crystals/carbonates/MgCO3-Magnesite.cif
/usr/share/avogadro2/crystals/carbonates/Na2CO3-Natrite.cif
/usr/share/avogadro2/crystals/clays
/usr/share/avogadro2/crystals/clays/Al2Si2O9H4-Dickite.cif
/usr/share/avogadro2/crystals/clays/Al2Si2O9H4-Kaolinite.cif
/usr/share/avogadro2/crystals/clays/Al2Si2O9H4-Nacrite.cif
/usr/share/avogadro2/crystals/clays/Al2Si4O12Ca0.5-Montmorillonite.cif
/usr/share/avogadro2/crystals/clays/Al4KSi2O12-Illite.cif
/usr/share/avogadro2/crystals/clays/AlSi2O6H-Pyrophyllite.cif
/usr/share/avogadro2/crystals/clays/Fe2.25Cl0.5H2.75-Fougerite.cif
/usr/share/avogadro2/crystals/clays/FeSi2O6H-Nontronite.cif
/usr/share/avogadro2/crystals/clays/Lepidolite.cif
/usr/share/avogadro2/crystals/clays/Mg2Al2SiO9H4-Amesite.cif
/usr/share/avogadro2/crystals/clays/Mg3(O12Si4)H2-Vermiculite.cif
/usr/share/avogadro2/crystals/clays/Mg4Si6O22.82H13.64-Sepiolite.cif
/usr/share/avogadro2/crystals/clays/Mn1.854Fe1.656Mg0.537Si0.953O9H4-Guidottiite.cif
/usr/share/avogadro2/crystals/clays/Zn2SiO5H2-Hemimorphite.cif
/usr/share/avogadro2/crystals/elements
/usr/share/avogadro2/crystals/elements/Ac-Actinium.cif
/usr/share/avogadro2/crystals/elements/Ag-Silver.cif
/usr/share/avogadro2/crystals/elements/Al-Aluminum.cif
/usr/share/avogadro2/crystals/elements/Am-Americium.cif
/usr/share/avogadro2/crystals/elements/Ar-Argon.cif
/usr/share/avogadro2/crystals/elements/As-Arsenic.cif
/usr/share/avogadro2/crystals/elements/As-Arsenolamprite.cif
/usr/share/avogadro2/crystals/elements/Au-Gold.cif
/usr/share/avogadro2/crystals/elements/B-Boron.cif
/usr/share/avogadro2/crystals/elements/Ba-Barium.cif
/usr/share/avogadro2/crystals/elements/Be-Beryllium.cif
/usr/share/avogadro2/crystals/elements/Bi-Bismuth.cif
/usr/share/avogadro2/crystals/elements/Br-Bromine.cif
/usr/share/avogadro2/crystals/elements/C-Diamond.cif
/usr/share/avogadro2/crystals/elements/C-Graphite.cif
/usr/share/avogadro2/crystals/elements/C-Lonsdaleite.cif
/usr/share/avogadro2/crystals/elements/Ca-Calcium-alpha.cif
/usr/share/avogadro2/crystals/elements/Ca-Calcium-beta.cif
/usr/share/avogadro2/crystals/elements/Ca-Calcium-gamma.cif
/usr/share/avogadro2/crystals/elements/Cd-Cadmium.cif
/usr/share/avogadro2/crystals/elements/Ce-Cerium.cif
/usr/share/avogadro2/crystals/elements/Cl-Chlorine.cif
/usr/share/avogadro2/crystals/elements/Co-Cobalt.cif
/usr/share/avogadro2/crystals/elements/Cr-Chromium.cif
/usr/share/avogadro2/crystals/elements/Cs-Cesium.cif
/usr/share/avogadro2/crystals/elements/Cu-Copper.cif
/usr/share/avogadro2/crystals/elements/Dy-Dysprosium.cif
/usr/share/avogadro2/crystals/elements/Er-Erbium.cif
/usr/share/avogadro2/crystals/elements/Eu-Europium.cif
/usr/share/avogadro2/crystals/elements/Fe-Iron-alpha.cif
/usr/share/avogadro2/crystals/elements/Fe-Iron-beta.cif
/usr/share/avogadro2/crystals/elements/Fe-Iron-delta.cif
/usr/share/avogadro2/crystals/elements/Fe-Iron-gamma.cif
/usr/share/avogadro2/crystals/elements/Ga-Gallium.cif
/usr/share/avogadro2/crystals/elements/Gd-Gadolinium.cif
/usr/share/avogadro2/crystals/elements/Ge-Germanium.cif
/usr/share/avogadro2/crystals/elements/He-Helium.cif
/usr/share/avogadro2/crystals/elements/Hf-Hafnium.cif
/usr/share/avogadro2/crystals/elements/Ho-Holmium.cif
/usr/share/avogadro2/crystals/elements/I-Iodine.cif
/usr/share/avogadro2/crystals/elements/In-Indium.cif
/usr/share/avogadro2/crystals/elements/Ir-Iridium.cif
/usr/share/avogadro2/crystals/elements/K-Potassium.cif
/usr/share/avogadro2/crystals/elements/Kr-Krypton.cif
/usr/share/avogadro2/crystals/elements/La-Lanthanum.cif
/usr/share/avogadro2/crystals/elements/Li-Lithium.cif
/usr/share/avogadro2/crystals/elements/Lu-Lutetium.cif
/usr/share/avogadro2/crystals/elements/Mg-Magnesium.cif
/usr/share/avogadro2/crystals/elements/Mn-Manganese-alpha.cif
/usr/share/avogadro2/crystals/elements/Mn-Manganese-delta.cif
/usr/share/avogadro2/crystals/elements/Mn-Manganese-gamma.cif
/usr/share/avogadro2/crystals/elements/Mo-Molybdenum.cif
/usr/share/avogadro2/crystals/elements/N-Nitrogen.cif
/usr/share/avogadro2/crystals/elements/Na-Sodium.cif
/usr/share/avogadro2/crystals/elements/Nb-Niobium.cif
/usr/share/avogadro2/crystals/elements/Nd-Neodymium.cif
/usr/share/avogadro2/crystals/elements/Ne-Neon.cif
/usr/share/avogadro2/crystals/elements/Ni-Nickel.cif
/usr/share/avogadro2/crystals/elements/Np-Neptunium-alpha.cif
/usr/share/avogadro2/crystals/elements/Np-Neptunium-beta.cif
/usr/share/avogadro2/crystals/elements/Np-Neptunium-gamma.cif
/usr/share/avogadro2/crystals/elements/Os-Osmium.cif
/usr/share/avogadro2/crystals/elements/P-Phosphorus-black.cif
/usr/share/avogadro2/crystals/elements/P-Phosphorus.cif
/usr/share/avogadro2/crystals/elements/Pb-Lead.cif
/usr/share/avogadro2/crystals/elements/Pd-Palladium.cif
/usr/share/avogadro2/crystals/elements/Pr-Praseodymium.cif
/usr/share/avogadro2/crystals/elements/Pt-Platinum.cif
/usr/share/avogadro2/crystals/elements/Pu-Plutonium-alpha.cif
/usr/share/avogadro2/crystals/elements/Pu-Plutonium-epsilon.cif
/usr/share/avogadro2/crystals/elements/Pu-Plutonium-gamma.cif
/usr/share/avogadro2/crystals/elements/Rb-Rubidium.cif
/usr/share/avogadro2/crystals/elements/Re-Rhenium.cif
/usr/share/avogadro2/crystals/elements/Rh-Rhodium.cif
/usr/share/avogadro2/crystals/elements/Ru-Ruthenium.cif
/usr/share/avogadro2/crystals/elements/S6-Sulfur.cif
/usr/share/avogadro2/crystals/elements/S8-Sulfur-alpha.cif
/usr/share/avogadro2/crystals/elements/S8-Sulfur-beta.cif
/usr/share/avogadro2/crystals/elements/S8-Sulfur-gamma.cif
/usr/share/avogadro2/crystals/elements/Sb-Antimony.cif
/usr/share/avogadro2/crystals/elements/Sc-Scandium.cif
/usr/share/avogadro2/crystals/elements/Se-Selenium.cif
/usr/share/avogadro2/crystals/elements/Si-Silicon.cif
/usr/share/avogadro2/crystals/elements/Sm-Samarium.cif
/usr/share/avogadro2/crystals/elements/Sn-Tin-alpha.cif
/usr/share/avogadro2/crystals/elements/Sn-Tin-beta.cif
/usr/share/avogadro2/crystals/elements/Sr-Strontium.cif
/usr/share/avogadro2/crystals/elements/Ta-Tantalum.cif
/usr/share/avogadro2/crystals/elements/Tb-Terbium.cif
/usr/share/avogadro2/crystals/elements/Te-Tellurium.cif
/usr/share/avogadro2/crystals/elements/Th-Thorium.cif
/usr/share/avogadro2/crystals/elements/Ti-Titanium-alpha.cif
/usr/share/avogadro2/crystals/elements/Ti-Titanium-beta.cif
/usr/share/avogadro2/crystals/elements/Tl-Thallium.cif
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@ghutchis
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I'm not sure what the problem is .. They don't have antechamber installed. Should we just swallow error messages? In that case, no one will be able to debug scripts.

What's your suggestion? Not including scripts like this in the default install?

@sagitter
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What i observed is that this command is executed without error:

$ python3 /usr/lib64/avogadro2/scripts/charges/antechamber.py --help
usage: AM1-BCC partial charges [-h] [--display-name] [--metadata] [--charges] [--potential] [--lang [LANG]]

options:
  -h, --help      show this help message and exit
  --display-name
  --metadata
  --charges
  --potential
  --lang [LANG]

or

$ python3 /usr/lib64/avogadro2/scripts/charges/antechamber.py  --lang en_US
$

The error comes out when i use the --display-name option

@ghutchis
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The whole point is that antechamber isn't in the PATH so the script should fail.

Do you think there shouldn't be some sort of message?

What do you think the behavior should be instead?

ghutchis added a commit to ghutchis/avogadrolibs that referenced this issue Sep 11, 2023
@ghutchis
Give better warnings when scripts do not load
8579443 
Fix OpenChemistry#1323 - now indicates Cannot load script /path/to/antechamber.py
Also enables i18n of script loader strings

Signed-off-by: Geoff Hutchison <geoff.hutchison@gmail.com>
@ghutchis ghutchis mentioned this issue Sep 11, 2023
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Here are the build results
Avogadro2.AppImage
macOS.dmg
Ubuntu-Latest.tar.gz
Win64.exe
Artifacts will only be retained for 90 days.

ghutchis added a commit that referenced this issue Sep 11, 2023
@ghutchis
Give better warnings when scripts do not load (#1336)
7ed1c8c 
* Give better warnings when scripts do not load

Fix #1323 - now indicates Cannot load script /path/to/antechamber.py
Also enables i18n of script loader strings

Signed-off-by: Geoff Hutchison <geoff.hutchison@gmail.com>
@github-actions
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Here are the build results
Avogadro2.AppImage
macOS.dmg
Ubuntu-Latest.tar.gz
Win64.exe
Artifacts will only be retained for 90 days.

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avo-bot commented Oct 4, 2023

This issue has been mentioned on Avogadro Discussion. There might be relevant details there:

https://discuss.avogadro.cc/t/errors-in-released-package-for-linux/4883/2

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Give better warnings when scripts do not load ghutchis/avogadrolibs
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@ghutchis @sagitter @avo-bot