Opened 2 years ago
Closed 2 years ago
#9977 closed defect (not a bug)
Didn't find section 'Peptide bond' in tab 'ISOLDE'
Reported by: | Owned by: | Tristan Croll | |
---|---|---|---|
Priority: | normal | Milestone: | |
Component: | Third Party | Version: | |
Keywords: | Cc: | ||
Blocked By: | Blocking: | ||
Notify when closed: | Platform: | all | |
Project: | ChimeraX |
Description
The following bug report has been submitted: Platform: Windows-10-10.0.22621 ChimeraX Version: 1.6.1 (2023-05-09 17:57:07 UTC) Description (Describe the actions that caused this problem to occur here) Log: UCSF ChimeraX version: 1.6.1 (2023-05-09) © 2016-2023 Regents of the University of California. All rights reserved. How to cite UCSF ChimeraX > toolshed show Downloading bundle ChimeraX_ISOLDE-1.6.0-cp39-cp39-win_amd64.whl Errors may have occurred when running pip: pip standard error: \--- [notice] A new release of pip is available: 23.0 -> 23.2.1 [notice] To update, run: C:\Program Files\ChimeraX\bin\ChimeraX.exe -m pip install --upgrade pip \--- pip standard output: \--- Looking in indexes: https://pypi.org/simple, https://cxtoolshed.rbvi.ucsf.edu/pypi/ Processing c:\users\mager\downloads\chimerax_isolde-1.6.0-cp39-cp39-win_amd64.whl Requirement already satisfied: ChimeraX-AtomicLibrary~=10.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-ISOLDE==1.6.0) (10.0.6) Requirement already satisfied: ChimeraX-Arrays~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-ISOLDE==1.6.0) (1.1) Requirement already satisfied: ChimeraX-Core<1.7,>=1.6rc202304252053 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-ISOLDE==1.6.0) (1.6.1) Requirement already satisfied: ChimeraX-Atomic~=1.36 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-ISOLDE==1.6.0) (1.43.10) Collecting ChimeraX-Clipper~=0.21.0 Downloading https://cxtoolshed.rbvi.ucsf.edu/media/chimeraxclipper/releases/0.21.0/ChimeraX_Clipper-0.21.0-cp39-cp39-win_amd64.whl (7.4 MB) \---------------------------------------- 7.4/7.4 MB 1.1 MB/s eta 0:00:00 Requirement already satisfied: ChimeraX-PDBLibrary~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Atomic~=1.36->ChimeraX- ISOLDE==1.6.0) (1.0.2) Requirement already satisfied: ChimeraX-mmCIF~=2.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Atomic~=1.36->ChimeraX- ISOLDE==1.6.0) (2.12) Requirement already satisfied: ChimeraX-Nucleotides~=2.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Atomic~=1.36->ChimeraX- ISOLDE==1.6.0) (2.0.3) Requirement already satisfied: ChimeraX-Geometry~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Atomic~=1.36->ChimeraX- ISOLDE==1.6.0) (1.3) Requirement already satisfied: ChimeraX-ConnectStructure~=2.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Atomic~=1.36->ChimeraX- ISOLDE==1.6.0) (2.0.1) Requirement already satisfied: ChimeraX-PDB~=2.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Atomic~=1.36->ChimeraX- ISOLDE==1.6.0) (2.7.2) Requirement already satisfied: ChimeraX-Graphics~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Atomic~=1.36->ChimeraX- ISOLDE==1.6.0) (1.1.1) Requirement already satisfied: ChimeraX-SaveCommand~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-mmCIF~=2.0->ChimeraX- Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.5.1) Requirement already satisfied: ChimeraX-OpenCommand~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-mmCIF~=2.0->ChimeraX- Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.10.1) Requirement already satisfied: ChimeraX-DataFormats~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-mmCIF~=2.0->ChimeraX- Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.2.3) Requirement already satisfied: ChimeraX-UI~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX- Nucleotides~=2.0->ChimeraX-Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.28.4) Requirement already satisfied: ChimeraX-Surface~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX- Nucleotides~=2.0->ChimeraX-Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.0.1) Requirement already satisfied: ChimeraX-IO~=1.0.1 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-PDB~=2.0->ChimeraX- Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.0.1) Requirement already satisfied: ChimeraX-Map~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Surface~=1.0->ChimeraX- Nucleotides~=2.0->ChimeraX-Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.1.4) Requirement already satisfied: ChimeraX-StdCommands~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Surface~=1.0->ChimeraX- Nucleotides~=2.0->ChimeraX-Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.10.3) Requirement already satisfied: ChimeraX-MapData~=2.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Surface~=1.0->ChimeraX- Nucleotides~=2.0->ChimeraX-Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (2.0) Requirement already satisfied: ChimeraX-MouseModes~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-UI~=1.0->ChimeraX- Nucleotides~=2.0->ChimeraX-Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.2) Requirement already satisfied: ChimeraX-SelInspector~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-UI~=1.0->ChimeraX- Nucleotides~=2.0->ChimeraX-Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.0) Requirement already satisfied: ChimeraX-MapFilter~=2.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Map~=1.0->ChimeraX- Surface~=1.0->ChimeraX-Nucleotides~=2.0->ChimeraX-Atomic~=1.36->ChimeraX- ISOLDE==1.6.0) (2.0.1) Requirement already satisfied: ChimeraX-MapSeries~=2.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX-Map~=1.0->ChimeraX- Surface~=1.0->ChimeraX-Nucleotides~=2.0->ChimeraX-Atomic~=1.36->ChimeraX- ISOLDE==1.6.0) (2.1.1) Requirement already satisfied: ChimeraX-ItemsInspection~=1.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX- SelInspector~=1.0->ChimeraX-UI~=1.0->ChimeraX-Nucleotides~=2.0->ChimeraX- Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.0.1) Requirement already satisfied: ChimeraX-Dssp~=2.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX- StdCommands~=1.0->ChimeraX-Surface~=1.0->ChimeraX-Nucleotides~=2.0->ChimeraX- Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (2.0) Requirement already satisfied: ChimeraX-MapFit~=2.0 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX- StdCommands~=1.0->ChimeraX-Surface~=1.0->ChimeraX-Nucleotides~=2.0->ChimeraX- Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (2.0) Requirement already satisfied: ChimeraX-DistMonitor~=1.2 in c:\program files\chimerax\bin\lib\site-packages (from ChimeraX- StdCommands~=1.0->ChimeraX-Surface~=1.0->ChimeraX-Nucleotides~=2.0->ChimeraX- Atomic~=1.36->ChimeraX-ISOLDE==1.6.0) (1.4) Installing collected packages: ChimeraX-Clipper, ChimeraX-ISOLDE Successfully installed ChimeraX-Clipper-0.21.0 ChimeraX-ISOLDE-1.6.0 \--- Successfully installed ChimeraX-Clipper-0.21.0 ChimeraX-ISOLDE-1.6.0 Installed ChimeraX-Clipper (0.21.0) Installed ChimeraX-ISOLDE (1.6.0) > open 4obe format mmcif fromDatabase pdb Summary of feedback from opening 4obe fetched from pdb --- warning | Atom H1 is not in the residue template for GLY /B:0 notes | Fetching compressed mmCIF 4obe from http://files.rcsb.org/download/4obe.cif Fetching CCD MG from https://files.wwpdb.org/pub/pdb/refdata/chem_comp/G/MG/MG.cif 4obe title: Crystal Structure of GDP-bound Human KRas [more info...] Chain information for 4obe #1 --- Chain | Description | UniProt A B | GTPase KRas | RASK_HUMAN 1-169 Non-standard residues in 4obe #1 --- GDP — guanosine-5'-diphosphate MG — magnesium ion 4obe mmCIF Assemblies --- 1| author_and_software_defined_assembly 2| author_and_software_defined_assembly > ui tool show "Ramachandran Plot" Cached rama8000-cispro data not found. Regenerating from text file. This is normal if running ISOLDE for the first time Cached rama8000-transpro data not found. Regenerating from text file. This is normal if running ISOLDE for the first time Cached rama8000-gly-sym data not found. Regenerating from text file. This is normal if running ISOLDE for the first time Cached rama8000-prepro-noGP data not found. Regenerating from text file. This is normal if running ISOLDE for the first time Cached rama8000-ileval-nopreP data not found. Regenerating from text file. This is normal if running ISOLDE for the first time Cached rama8000-general-noGPIVpreP data not found. Regenerating from text file. This is normal if running ISOLDE for the first time > close session > 6f0a Unknown command: 6f0a > open 6f0a Summary of feedback from opening 6f0a fetched from pdb --- notes | Fetching compressed mmCIF 6f0a from http://files.rcsb.org/download/6f0a.cif Fetching CCD C82 from https://files.wwpdb.org/pub/pdb/refdata/chem_comp/2/C82/C82.cif Fetching CCD HEM from https://files.wwpdb.org/pub/pdb/refdata/chem_comp/M/HEM/HEM.cif 6f0a title: Crystal structure of human indoleamine 2,3-dioxygenase bound to a triazole inhibitor and alanine molecule. [more info...] Chain information for 6f0a #1 --- Chain | Description | UniProt A C | Indoleamine 2,3-dioxygenase 1 | I23O1_HUMAN 11-403 Non-standard residues in 6f0a #1 --- ALA — alanine C82 — ~{N}-(4-chlorophenyl)-1~{H}-1,2,3-triazol-5-amine HEM — protoporphyrin IX containing Fe (HEME) 6f0a mmCIF Assemblies --- 1| author_defined_assembly 2| author_defined_assembly Traceback (most recent call last): File "C:\Program Files\ChimeraX\bin\lib\site- packages\matplotlib\cbook\\__init__.py", line 307, in process func(*args, **kwargs) File "C:\Users\mager\AppData\Local\UCSF\ChimeraX\1.6\site- packages\chimerax\isolde\validation\ramaplot\ramaplot.py", line 307, in on_pick get_stepper(self.current_model).step_to(picked_rama.residue) File "C:\Users\mager\AppData\Local\UCSF\ChimeraX\1.6\site- packages\chimerax\isolde\navigate.py", line 143, in step_to self._new_camera_position(residue) File "C:\Users\mager\AppData\Local\UCSF\ChimeraX\1.6\site- packages\chimerax\isolde\navigate.py", line 232, in _new_camera_position interpolate_camera(session, 0, frames=1) File "C:\Users\mager\AppData\Local\UCSF\ChimeraX\1.6\site- packages\chimerax\isolde\navigate.py", line 217, in interpolate_camera ncp, fcp = _get_clip_points(session, dist) File "C:\Users\mager\AppData\Local\UCSF\ChimeraX\1.6\site- packages\chimerax\isolde\navigate.py", line 360, in _get_clip_points return (o+vd*dist*0.5, o+vd*dist*1.5) UnboundLocalError: local variable 'o' referenced before assignment Traceback (most recent call last): File "C:\Program Files\ChimeraX\bin\lib\site- packages\chimerax\core\triggerset.py", line 138, in invoke return self._func(self._name, data) File "C:\Users\mager\AppData\Local\UCSF\ChimeraX\1.6\site- packages\chimerax\isolde\toolbar.py", line 330, in _selection_changed_cb self._enable_if_single_peptide_selected_cb() File "C:\Users\mager\AppData\Local\UCSF\ChimeraX\1.6\site- packages\chimerax\isolde\toolbar.py", line 316, in _enable_if_single_peptide_selected_cb self.set_enabled(key, enable) File "C:\Users\mager\AppData\Local\UCSF\ChimeraX\1.6\site- packages\chimerax\isolde\toolbar.py", line 127, in set_enabled self.session.toolbar.set_enabled(enabled, tab, section, display_name) File "C:\Program Files\ChimeraX\bin\lib\site- packages\chimerax\toolbar\manager.py", line 164, in set_enabled tb.set_enabled(enabled, tab_title, section_title, button_title) File "C:\Program Files\ChimeraX\bin\lib\site- packages\chimerax\toolbar\tool.py", line 246, in set_enabled self.ttb.set_enabled(enabled, tab_title, section_title, button_title) File "C:\Program Files\ChimeraX\bin\lib\site- packages\chimerax\ui\widgets\tabbedtoolbar.py", line 496, in set_enabled raise ValueError(f"Didn't find section '{section_title}' in tab '{tab_title}'") ValueError: Didn't find section 'Peptide bond' in tab 'ISOLDE' Error processing trigger "selection changed": ValueError: Didn't find section 'Peptide bond' in tab 'ISOLDE' File "C:\Program Files\ChimeraX\bin\lib\site- packages\chimerax\ui\widgets\tabbedtoolbar.py", line 496, in set_enabled raise ValueError(f"Didn't find section '{section_title}' in tab '{tab_title}'") See log for complete Python traceback. OpenGL version: 3.3.0 - Build 30.0.100.9864 OpenGL renderer: Intel(R) Iris(R) Plus Graphics OpenGL vendor: Intel Python: 3.9.11 Locale: fr_CH.cp1252 Qt version: PyQt6 6.4.2, Qt 6.4.2 Qt runtime version: 6.4.3 Qt platform: windows Manufacturer: ASUSTeK COMPUTER INC. Model: VivoBook_ASUSLaptop X512JA_X512JA OS: Microsoft Windows 11 Famille (Build 22621) Memory: 12,681,240,576 MaxProcessMemory: 137,438,953,344 CPU: 8 Intel(R) Core(TM) i7-1065G7 CPU @ 1.30GHz OSLanguage: fr-FR Installed Packages: alabaster: 0.7.13 appdirs: 1.4.4 asttokens: 2.2.1 Babel: 2.12.1 backcall: 0.2.0 beautifulsoup4: 4.11.2 blockdiag: 3.0.0 build: 0.10.0 certifi: 2023.5.7 cftime: 1.6.2 charset-normalizer: 3.1.0 ChimeraX-AddCharge: 1.5.9.1 ChimeraX-AddH: 2.2.5 ChimeraX-AlignmentAlgorithms: 2.0.1 ChimeraX-AlignmentHdrs: 3.3.1 ChimeraX-AlignmentMatrices: 2.1 ChimeraX-Alignments: 2.9.3 ChimeraX-AlphaFold: 1.0 ChimeraX-AltlocExplorer: 1.0.3 ChimeraX-AmberInfo: 1.0 ChimeraX-Arrays: 1.1 ChimeraX-Atomic: 1.43.10 ChimeraX-AtomicLibrary: 10.0.6 ChimeraX-AtomSearch: 2.0.1 ChimeraX-AxesPlanes: 2.3.2 ChimeraX-BasicActions: 1.1.2 ChimeraX-BILD: 1.0 ChimeraX-BlastProtein: 2.1.2 ChimeraX-BondRot: 2.0.1 ChimeraX-BugReporter: 1.0.1 ChimeraX-BuildStructure: 2.8 ChimeraX-Bumps: 1.0 ChimeraX-BundleBuilder: 1.2.2 ChimeraX-ButtonPanel: 1.0.1 ChimeraX-CageBuilder: 1.0.1 ChimeraX-CellPack: 1.0 ChimeraX-Centroids: 1.3.2 ChimeraX-ChangeChains: 1.0.2 ChimeraX-CheckWaters: 1.3.1 ChimeraX-ChemGroup: 2.0.1 ChimeraX-Clashes: 2.2.4 ChimeraX-Clipper: 0.21.0 ChimeraX-ColorActions: 1.0.3 ChimeraX-ColorGlobe: 1.0 ChimeraX-ColorKey: 1.5.3 ChimeraX-CommandLine: 1.2.5 ChimeraX-ConnectStructure: 2.0.1 ChimeraX-Contacts: 1.0.1 ChimeraX-Core: 1.6.1 ChimeraX-CoreFormats: 1.1 ChimeraX-coulombic: 1.4.2 ChimeraX-Crosslinks: 1.0 ChimeraX-Crystal: 1.0 ChimeraX-CrystalContacts: 1.0.1 ChimeraX-DataFormats: 1.2.3 ChimeraX-Dicom: 1.2 ChimeraX-DistMonitor: 1.4 ChimeraX-DockPrep: 1.1.1 ChimeraX-Dssp: 2.0 ChimeraX-EMDB-SFF: 1.0 ChimeraX-ESMFold: 1.0 ChimeraX-FileHistory: 1.0.1 ChimeraX-FunctionKey: 1.0.1 ChimeraX-Geometry: 1.3 ChimeraX-gltf: 1.0 ChimeraX-Graphics: 1.1.1 ChimeraX-Hbonds: 2.4 ChimeraX-Help: 1.2.1 ChimeraX-HKCage: 1.3 ChimeraX-IHM: 1.1 ChimeraX-ImageFormats: 1.2 ChimeraX-IMOD: 1.0 ChimeraX-IO: 1.0.1 ChimeraX-ISOLDE: 1.6.0 ChimeraX-ItemsInspection: 1.0.1 ChimeraX-Label: 1.1.7 ChimeraX-ListInfo: 1.1.1 ChimeraX-Log: 1.1.5 ChimeraX-LookingGlass: 1.1 ChimeraX-Maestro: 1.8.2 ChimeraX-Map: 1.1.4 ChimeraX-MapData: 2.0 ChimeraX-MapEraser: 1.0.1 ChimeraX-MapFilter: 2.0.1 ChimeraX-MapFit: 2.0 ChimeraX-MapSeries: 2.1.1 ChimeraX-Markers: 1.0.1 ChimeraX-Mask: 1.0.2 ChimeraX-MatchMaker: 2.0.12 ChimeraX-MDcrds: 2.6 ChimeraX-MedicalToolbar: 1.0.2 ChimeraX-Meeting: 1.0.1 ChimeraX-MLP: 1.1.1 ChimeraX-mmCIF: 2.12 ChimeraX-MMTF: 2.2 ChimeraX-Modeller: 1.5.9 ChimeraX-ModelPanel: 1.3.7 ChimeraX-ModelSeries: 1.0.1 ChimeraX-Mol2: 2.0 ChimeraX-Mole: 1.0 ChimeraX-Morph: 1.0.2 ChimeraX-MouseModes: 1.2 ChimeraX-Movie: 1.0 ChimeraX-Neuron: 1.0 ChimeraX-Nifti: 1.0 ChimeraX-NRRD: 1.0 ChimeraX-Nucleotides: 2.0.3 ChimeraX-OpenCommand: 1.10.1 ChimeraX-PDB: 2.7.2 ChimeraX-PDBBio: 1.0 ChimeraX-PDBLibrary: 1.0.2 ChimeraX-PDBMatrices: 1.0 ChimeraX-PickBlobs: 1.0.1 ChimeraX-Positions: 1.0 ChimeraX-PresetMgr: 1.1 ChimeraX-PubChem: 2.1 ChimeraX-ReadPbonds: 1.0.1 ChimeraX-Registration: 1.1.1 ChimeraX-RemoteControl: 1.0 ChimeraX-RenderByAttr: 1.1 ChimeraX-RenumberResidues: 1.1 ChimeraX-ResidueFit: 1.0.1 ChimeraX-RestServer: 1.1 ChimeraX-RNALayout: 1.0 ChimeraX-RotamerLibMgr: 3.0 ChimeraX-RotamerLibsDunbrack: 2.0 ChimeraX-RotamerLibsDynameomics: 2.0 ChimeraX-RotamerLibsRichardson: 2.0 ChimeraX-SaveCommand: 1.5.1 ChimeraX-SchemeMgr: 1.0 ChimeraX-SDF: 2.0.1 ChimeraX-Segger: 1.0 ChimeraX-Segment: 1.0.1 ChimeraX-SelInspector: 1.0 ChimeraX-SeqView: 2.8.3 ChimeraX-Shape: 1.0.1 ChimeraX-Shell: 1.0.1 ChimeraX-Shortcuts: 1.1.1 ChimeraX-ShowSequences: 1.0.1 ChimeraX-SideView: 1.0.1 ChimeraX-Smiles: 2.1 ChimeraX-SmoothLines: 1.0 ChimeraX-SpaceNavigator: 1.0 ChimeraX-StdCommands: 1.10.3 ChimeraX-STL: 1.0.1 ChimeraX-Storm: 1.0 ChimeraX-StructMeasure: 1.1.2 ChimeraX-Struts: 1.0.1 ChimeraX-Surface: 1.0.1 ChimeraX-SwapAA: 2.0.1 ChimeraX-SwapRes: 2.2.1 ChimeraX-TapeMeasure: 1.0 ChimeraX-Test: 1.0 ChimeraX-Toolbar: 1.1.2 ChimeraX-ToolshedUtils: 1.2.1 ChimeraX-Topography: 1.0 ChimeraX-Tug: 1.0.1 ChimeraX-UI: 1.28.4 ChimeraX-uniprot: 2.2.2 ChimeraX-UnitCell: 1.0.1 ChimeraX-ViewDockX: 1.2 ChimeraX-VIPERdb: 1.0 ChimeraX-Vive: 1.1 ChimeraX-VolumeMenu: 1.0.1 ChimeraX-VTK: 1.0 ChimeraX-WavefrontOBJ: 1.0 ChimeraX-WebCam: 1.0.2 ChimeraX-WebServices: 1.1.1 ChimeraX-Zone: 1.0.1 colorama: 0.4.6 comm: 0.1.3 comtypes: 1.1.14 contourpy: 1.0.7 cxservices: 1.2.2 cycler: 0.11.0 Cython: 0.29.33 debugpy: 1.6.7 decorator: 5.1.1 docutils: 0.19 executing: 1.2.0 filelock: 3.9.0 fonttools: 4.39.3 funcparserlib: 1.0.1 grako: 3.16.5 h5py: 3.8.0 html2text: 2020.1.16 idna: 3.4 ihm: 0.35 imagecodecs: 2022.9.26 imagesize: 1.4.1 importlib-metadata: 6.6.0 ipykernel: 6.21.1 ipython: 8.10.0 ipython-genutils: 0.2.0 ipywidgets: 8.0.6 jedi: 0.18.2 Jinja2: 3.1.2 jupyter-client: 8.0.2 jupyter-core: 5.3.0 jupyterlab-widgets: 3.0.7 kiwisolver: 1.4.4 line-profiler: 4.0.2 lxml: 4.9.2 lz4: 4.3.2 MarkupSafe: 2.1.2 matplotlib: 3.6.3 matplotlib-inline: 0.1.6 msgpack: 1.0.4 nest-asyncio: 1.5.6 netCDF4: 1.6.2 networkx: 2.8.8 nibabel: 5.0.1 nptyping: 2.5.0 numexpr: 2.8.4 numpy: 1.23.5 openvr: 1.23.701 packaging: 23.1 ParmEd: 3.4.3 parso: 0.8.3 pep517: 0.13.0 pickleshare: 0.7.5 Pillow: 9.3.0 pip: 23.0 pkginfo: 1.9.6 platformdirs: 3.5.0 prompt-toolkit: 3.0.38 psutil: 5.9.4 pure-eval: 0.2.2 pycollada: 0.7.2 pydicom: 2.3.0 Pygments: 2.14.0 pynrrd: 1.0.0 PyOpenGL: 3.1.5 PyOpenGL-accelerate: 3.1.5 pyparsing: 3.0.9 pyproject-hooks: 1.0.0 PyQt6-commercial: 6.4.2 PyQt6-Qt6: 6.4.3 PyQt6-sip: 13.4.1 PyQt6-WebEngine-commercial: 6.4.0 PyQt6-WebEngine-Qt6: 6.4.3 python-dateutil: 2.8.2 pytz: 2023.3 pywin32: 305 pyzmq: 25.0.2 qtconsole: 5.4.0 QtPy: 2.3.1 RandomWords: 0.4.0 requests: 2.28.2 scipy: 1.9.3 setuptools: 67.4.0 sfftk-rw: 0.7.3 six: 1.16.0 snowballstemmer: 2.2.0 sortedcontainers: 2.4.0 soupsieve: 2.4.1 sphinx: 6.1.3 sphinx-autodoc-typehints: 1.22 sphinxcontrib-applehelp: 1.0.4 sphinxcontrib-blockdiag: 3.0.0 sphinxcontrib-devhelp: 1.0.2 sphinxcontrib-htmlhelp: 2.0.1 sphinxcontrib-jsmath: 1.0.1 sphinxcontrib-qthelp: 1.0.3 sphinxcontrib-serializinghtml: 1.1.5 stack-data: 0.6.2 tables: 3.7.0 tcia-utils: 1.2.0 tifffile: 2022.10.10 tinyarray: 1.2.4 tomli: 2.0.1 tornado: 6.3.1 traitlets: 5.9.0 typing-extensions: 4.5.0 tzdata: 2023.3 urllib3: 1.26.15 wcwidth: 0.2.6 webcolors: 1.12 wheel: 0.38.4 wheel-filename: 1.4.1 widgetsnbextension: 4.0.7 WMI: 1.5.1 zipp: 3.15.0
Change History (2)
comment:1 by , 2 years ago
Component: | Unassigned → Third Party |
---|---|
Owner: | set to |
Platform: | → all |
Project: | → ChimeraX |
Status: | new → assigned |
Summary: | ChimeraX bug report submission → Didn't find section 'Peptide bond' in tab 'ISOLDE' |
comment:2 by , 2 years ago
Resolution: | → not a bug |
---|---|
Status: | assigned → closed |
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This is why, at the end of installation, ISOLDE pops up a dialog saying that ChimeraX needs to be restarted before using ISOLDE - its additions to the toolbar are only populated on ChimeraX startup. If the user ignores that message there's not much I can do about it - certainly *forcing* them to restart would be a terrible idea! I suppose I could catch this error and repeat the dialog if the user tries to start ISOLDE anyway...