Opened 5 years ago
Last modified 5 years ago
#4422 assigned defect
Version misreported
Reported by: | Tristan Croll | Owned by: | Greg Couch |
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Priority: | normal | Milestone: | |
Component: | Platform | Version: | |
Keywords: | Cc: | ||
Blocked By: | Blocking: | ||
Notify when closed: | Platform: | all | |
Project: | ChimeraX |
Description
The following bug report has been submitted: Platform: Linux-3.10.0-1127.19.1.el7.x86_64-x86_64-with-centos-7.8.2003-Core ChimeraX Version: 1.1 (2020-09-09 22:22:27 UTC) Description Super-minor thing, but I have both ChimeraX 1.1 and a recent daily build installed in the same Linux system. When I'm running 1.1, the version is misreported as 1.2.dev... in the Linux menu bar (see attached screenshot). Log: > alias preview_toolshed toolshed url https://cxtoolshed- > preview.rbvi.ucsf.edu; toolshed reload available > alias production_toolshed toolshed url https://cxtoolshed.rbvi.ucsf.edu; > toolshed reload available > alias st isolde step $* > alias aw isolde add water $* > alias awsf isolde add water sim false > alias al isolde add ligand $* > alias so setattr sel atoms occupancy $* UCSF ChimeraX version: 1.1 (2020-09-09) © 2016-2020 Regents of the University of California. All rights reserved. How to cite UCSF ChimeraX > open 7bv2.pdb 7bv2.pdb title: The NSP12-NSP7-NSP8 complex bound to the template-primer RNA and triphosphate form of remdesivir(RTP) [more info...] Chain information for 7bv2.pdb #1 --- Chain | Description A | sars-cov-2 NSP12 B | sars-cov-2 NSP8 C | sars-cov-2 NSP7 P | primer T | templete Non-standard residues in 7bv2.pdb #1 --- F86 — [(2~{R},3~{S},4~{R},5~{R})-5-(4-azanylpyrrolo[2,1-F][1,2,4]triazin-7-yl)-5-cyano-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate MG — magnesium ion POP — pyrophosphate 2- ZN — zinc ion > open working.cif Summary of feedback from opening working.cif --- warnings | Unknown polymer entity '1' near line 155 Unknown polymer entity '2' near line 13550 Unknown polymer entity '3' near line 15303 Unknown polymer entity '4' near line 16298 Unable to infer polymer connectivity due to unspecified label_seq_id for residue "RMP" near line 16648 Unknown polymer entity '5' near line 16684 Atom O2 is not in the residue template for RMP /P:101 Missing or incomplete entity_poly_seq table. Inferred polymer connectivity. note | Fetching CCD RMP from http://ligand-expo.rcsb.org/reports/R/RMP/RMP.cif Chain information for working.cif #2 --- Chain | Description A | ? B | ? C | ? P | ? T | ? > open EMD-30210.mrc Opened EMD-30210.mrc, grid size 192,192,192, pixel 1.01, shown at level 0.0278, step 1, values float32 > clipper associate #3 toModel #1 7bv2.pdb title: The NSP12-NSP7-NSP8 complex bound to the template-primer RNA and triphosphate form of remdesivir(RTP) [more info...] Chain information for 7bv2.pdb --- Chain | Description 1.2/A | sars-cov-2 NSP12 1.2/B | sars-cov-2 NSP8 1.2/C | sars-cov-2 NSP7 1.2/P | primer 1.2/T | templete Non-standard residues in 7bv2.pdb #1.2 --- F86 — [(2~{R},3~{S},4~{R},5~{R})-5-(4-azanylpyrrolo[2,1-F][1,2,4]triazin-7-yl)-5-cyano-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate MG — magnesium ion POP — pyrophosphate 2- ZN — zinc ion > clipper spotlight #2 Chain information for working.cif --- Chain | Description 2.2/A | ? 2.2/B | ? 2.2/C | ? 2.2/P | ? 2.2/T | ? > set bgColor white > isolde start > set selectionWidth 4 Done loading forcefield > volume gaussian #1 bfactor 50 > clipper associate #3 toModel #1 > addh Summary of feedback from adding hydrogens to multiple structures --- warnings | Not adding hydrogens to 7bv2.pdb #1.2/A LYS 98 CB because it is missing heavy-atom bond partners Not adding hydrogens to 7bv2.pdb #1.2/A ASP 100 CB because it is missing heavy-atom bond partners Not adding hydrogens to 7bv2.pdb #1.2/A ASP 218 CB because it is missing heavy-atom bond partners Not adding hydrogens to 7bv2.pdb #1.2/A ARG 365 CB because it is missing heavy-atom bond partners Not adding hydrogens to 7bv2.pdb #1.2/A ASP 824 CB because it is missing heavy-atom bond partners 19 messages similar to the above omitted notes | Termini for 7bv2.pdb (#1.2) chain A determined from SEQRES records Termini for 7bv2.pdb (#1.2) chain B determined from SEQRES records Termini for 7bv2.pdb (#1.2) chain C determined from SEQRES records Termini for 7bv2.pdb (#1.2) chain P determined from SEQRES records Termini for 7bv2.pdb (#1.2) chain T determined from SEQRES records Chain-initial residues that are actual N termini: Chain-initial residues that are not actual N termini: 7bv2.pdb #1.2/A VAL 31, 7bv2.pdb #1.2/A GLU 84, 7bv2.pdb #1.2/A ARG 118, 7bv2.pdb #1.2/A MET 906, 7bv2.pdb #1.2/B ASP 78, 7bv2.pdb #1.2/C LYS 2, 7bv2.pdb #1.2/P G 10, 7bv2.pdb #1.2/T U 8 Chain-final residues that are actual C termini: 7bv2.pdb #1.2/P U 20 Chain-final residues that are not actual C termini: 7bv2.pdb #1.2/A LYS 50, 7bv2.pdb #1.2/A ASP 100, 7bv2.pdb #1.2/A LEU 895, 7bv2.pdb #1.2/A GLU 919, 7bv2.pdb #1.2/B ALA 191, 7bv2.pdb #1.2/C GLY 64, 7bv2.pdb #1.2/T C 21 858 hydrogen bonds Adding 'H' to 7bv2.pdb #1.2/A VAL 31 Adding 'H' to 7bv2.pdb #1.2/A GLU 84 Adding 'H' to 7bv2.pdb #1.2/A ARG 118 Adding 'H' to 7bv2.pdb #1.2/A MET 906 Adding 'H' to 7bv2.pdb #1.2/B ASP 78 1 messages similar to the above omitted 7bv2.pdb #1.2/A GLU 919 is not terminus, removing H atom from 'C' 7bv2.pdb #1.2/B ALA 191 is not terminus, removing H atom from 'C' 7bv2.pdb #1.2/C GLY 64 is not terminus, removing H atom from 'C' No usable SEQRES records for working.cif (#2.2) chain A; guessing termini instead No usable SEQRES records for working.cif (#2.2) chain B; guessing termini instead No usable SEQRES records for working.cif (#2.2) chain C; guessing termini instead No usable SEQRES records for working.cif (#2.2) chain P; guessing termini instead No usable SEQRES records for working.cif (#2.2) chain T; guessing termini instead Chain-initial residues that are actual N termini: working.cif #2.2/A VAL 31, working.cif #2.2/B ASP 78, working.cif #2.2/C LYS 2, working.cif #2.2/P G 10, working.cif #2.2/T U 8 Chain-initial residues that are not actual N termini: working.cif #2.2/A GLU 84, working.cif #2.2/A ARG 118, working.cif #2.2/A ASN 911 Chain-final residues that are actual C termini: working.cif #2.2/P RMP 101, working.cif #2.2/T C 21 Chain-final residues that are not actual C termini: working.cif #2.2/A THR 929, working.cif #2.2/A LYS 50, working.cif #2.2/A ASP 100, working.cif #2.2/A LEU 895, working.cif #2.2/B ALA 191, working.cif #2.2/C GLY 64 1149 hydrogen bonds working.cif #2.2/A THR 929 is not terminus, removing H atom from 'C' working.cif #2.2/B ALA 191 is not terminus, removing H atom from 'C' working.cif #2.2/C GLY 64 is not terminus, removing H atom from 'C' 8099 hydrogens added > hide #!2 models > view /A:505 > show #!2 models > hide #!1 models > show #!1 models > hide #!2 models > show #!2 models > hide #!2 models > select clear > hide #!1.1.1.2 models > graphics silhouettes true > save b183_transpro.jpg > show #!2 models > hide #!1 models > show #!1 models > hide #!1.2 models > select clear > cofr showPivot false > hide #!2 models > show #!1.1.1.2 models > hide #!1.1.1.2 models > show #!1.2 models > select clear > save b183_transpro.jpg > hide #!1.2 models > show #!2 models > save b183_cisspro.jpg > view /A:505 > hide #!2 models > show #!1.2 models > view /B:505 No objects specified. > view /B:183 > hide #!1.2 models > show #!2 models > windowsize size Expected an integer >= 1 or a keyword > windowsize window size 1339 868 > save b183_cispro.png supersample 3 width 2678 height 1736 > show #!1.2 models > hide #!2 models > save b183_transpro.png supersample 3 width 2678 height 1736 OpenGL version: 3.3.0 NVIDIA 455.32.00 OpenGL renderer: TITAN Xp/PCIe/SSE2 OpenGL vendor: NVIDIA Corporation Manufacturer: Dell Inc. Model: Precision T5600 OS: CentOS Linux 7 Core Architecture: 64bit ELF CPU: 32 Intel(R) Xeon(R) CPU E5-2687W 0 @ 3.10GHz Cache Size: 20480 KB Memory: total used free shared buff/cache available Mem: 62G 4.4G 47G 156M 11G 57G Swap: 4.9G 0B 4.9G Graphics: 03:00.0 VGA compatible controller [0300]: NVIDIA Corporation GP102 [TITAN Xp] [10de:1b02] (rev a1) Subsystem: NVIDIA Corporation Device [10de:11df] Kernel driver in use: nvidia PyQt version: 5.12.3 Compiled Qt version: 5.12.4 Runtime Qt version: 5.12.9 Installed Packages: alabaster: 0.7.12 appdirs: 1.4.4 Babel: 2.8.0 backcall: 0.2.0 blockdiag: 2.0.1 certifi: 2020.6.20 chardet: 3.0.4 ChimeraX-AddH: 2.1.3 ChimeraX-AlignmentAlgorithms: 2.0 ChimeraX-AlignmentHdrs: 3.2 ChimeraX-AlignmentMatrices: 2.0 ChimeraX-Alignments: 2.1 ChimeraX-Arrays: 1.0 ChimeraX-Async: 0.1 ChimeraX-Atomic: 1.6.1 ChimeraX-AtomSearch: 2.0 ChimeraX-AxesPlanes: 2.0 ChimeraX-BasicActions: 1.1 ChimeraX-BILD: 1.0 ChimeraX-BlastProtein: 1.0.1 ChimeraX-BondRot: 2.0 ChimeraX-BugReporter: 1.0 ChimeraX-BuildStructure: 2.0 ChimeraX-Bumps: 1.0 ChimeraX-BundleBuilder: 1.0 ChimeraX-ButtonPanel: 1.0 ChimeraX-CageBuilder: 1.0 ChimeraX-CellPack: 1.0 ChimeraX-Centroids: 1.1 ChimeraX-ChemGroup: 2.0 ChimeraX-Clashes: 2.0 ChimeraX-Clipper: 0.15.0 ChimeraX-ColorActions: 1.0 ChimeraX-ColorGlobe: 1.0 ChimeraX-CommandLine: 1.1.3 ChimeraX-ConnectStructure: 2.0 ChimeraX-Contacts: 1.0 ChimeraX-Core: 1.1 ChimeraX-CoreFormats: 1.0 ChimeraX-coulombic: 1.0.1 ChimeraX-Crosslinks: 1.0 ChimeraX-Crystal: 1.0 ChimeraX-DataFormats: 1.0 ChimeraX-Dicom: 1.0 ChimeraX-DistMonitor: 1.1 ChimeraX-DistUI: 1.0 ChimeraX-Dssp: 2.0 ChimeraX-EMDB-SFF: 1.0 ChimeraX-ExperimentalCommands: 1.0 ChimeraX-FileHistory: 1.0 ChimeraX-FunctionKey: 1.0 ChimeraX-Geometry: 1.1 ChimeraX-gltf: 1.0 ChimeraX-Graphics: 1.0 ChimeraX-Hbonds: 2.0 ChimeraX-Help: 1.0 ChimeraX-HKCage: 1.3 ChimeraX-IHM: 1.0 ChimeraX-ImageFormats: 1.0 ChimeraX-IMOD: 1.0 ChimeraX-IO: 1.0 ChimeraX-ISOLDE: 1.1.0 ChimeraX-Label: 1.0 ChimeraX-LinuxSupport: 1.0 ChimeraX-ListInfo: 1.0 ChimeraX-Log: 1.1.1 ChimeraX-LookingGlass: 1.1 ChimeraX-Map: 1.0.1 ChimeraX-MapData: 2.0 ChimeraX-MapEraser: 1.0 ChimeraX-MapFilter: 2.0 ChimeraX-MapFit: 2.0 ChimeraX-MapSeries: 2.0 ChimeraX-Markers: 1.0 ChimeraX-Mask: 1.0 ChimeraX-MatchMaker: 1.1 ChimeraX-MDcrds: 2.0 ChimeraX-MedicalToolbar: 1.0.1 ChimeraX-Meeting: 1.0 ChimeraX-MLP: 1.0 ChimeraX-mmCIF: 2.2 ChimeraX-MMTF: 2.0 ChimeraX-Modeller: 1.0 ChimeraX-ModelPanel: 1.0 ChimeraX-ModelSeries: 1.0 ChimeraX-Mol2: 2.0 ChimeraX-Morph: 1.0 ChimeraX-MouseModes: 1.0 ChimeraX-Movie: 1.0 ChimeraX-Neuron: 1.0 ChimeraX-Nucleotides: 2.0 ChimeraX-OpenCommand: 1.2.1 ChimeraX-PDB: 2.1 ChimeraX-PDBBio: 1.0 ChimeraX-Phenix: 0.1 ChimeraX-PickBlobs: 1.0 ChimeraX-Positions: 1.0 ChimeraX-PresetMgr: 1.0 ChimeraX-PubChem: 2.0 ChimeraX-Read-Pbonds: 1.0 ChimeraX-Registration: 1.1 ChimeraX-RemoteControl: 1.0 ChimeraX-ResidueFit: 1.0 ChimeraX-RestServer: 1.0 ChimeraX-RNALayout: 1.0 ChimeraX-RotamerLibMgr: 2.0 ChimeraX-RotamerLibsDunbrack: 2.0 ChimeraX-RotamerLibsDynameomics: 2.0 ChimeraX-RotamerLibsRichardson: 2.0 ChimeraX-SaveCommand: 1.2 ChimeraX-SchemeMgr: 1.0 ChimeraX-SDF: 2.0 ChimeraX-Segger: 1.0 ChimeraX-Segment: 1.0 ChimeraX-SeqView: 2.2 ChimeraX-Shape: 1.0.1 ChimeraX-Shell: 1.0 ChimeraX-Shortcuts: 1.0 ChimeraX-ShowAttr: 1.0 ChimeraX-ShowSequences: 1.0 ChimeraX-SideView: 1.0 ChimeraX-Smiles: 2.0 ChimeraX-SmoothLines: 1.0 ChimeraX-SpaceNavigator: 1.0 ChimeraX-StdCommands: 1.0.4 ChimeraX-STL: 1.0 ChimeraX-Storm: 1.0 ChimeraX-Struts: 1.0 ChimeraX-Surface: 1.0 ChimeraX-SwapAA: 2.0 ChimeraX-SwapRes: 2.0 ChimeraX-TapeMeasure: 1.0 ChimeraX-Test: 1.0 ChimeraX-Toolbar: 1.0 ChimeraX-ToolshedUtils: 1.0 ChimeraX-Tug: 1.0 ChimeraX-UI: 1.2.3 ChimeraX-uniprot: 2.0 ChimeraX-ViewDockX: 1.0 ChimeraX-Vive: 1.1 ChimeraX-VolumeMenu: 1.0 ChimeraX-VTK: 1.0 ChimeraX-WavefrontOBJ: 1.0 ChimeraX-WebCam: 1.0 ChimeraX-WebServices: 1.0 ChimeraX-Zone: 1.0 colorama: 0.4.3 comtypes: 1.1.7 cxservices: 1.0 cycler: 0.10.0 Cython: 0.29.20 decorator: 4.4.2 distlib: 0.3.1 distro: 1.5.0 docutils: 0.16 filelock: 3.0.12 funcparserlib: 0.3.6 grako: 3.16.5 graphviz: 0.14.1 h5py: 2.10.0 html2text: 2020.1.16 idna: 2.10 ihm: 0.16 imagecodecs: 2020.5.30 imagecodecs-lite: 2020.1.31 imagesize: 1.2.0 ipykernel: 5.3.0 ipython: 7.15.0 ipython-genutils: 0.2.0 jedi: 0.17.2 Jinja2: 2.11.2 jupyter-client: 6.1.3 jupyter-core: 4.6.3 kiwisolver: 1.2.0 line-profiler: 2.1.2 lxml: 4.5.1 MarkupSafe: 1.1.1 matplotlib: 3.2.1 msgpack: 1.0.0 netifaces: 0.10.9 networkx: 2.4 numexpr: 2.7.1 numpy: 1.18.5 numpydoc: 1.0.0 objgraph: 3.4.1 openvr: 1.12.501 packaging: 20.4 ParmEd: 3.2.0 parso: 0.7.1 pexpect: 4.8.0 pickleshare: 0.7.5 Pillow: 7.1.2 pip: 20.2.2 pkginfo: 1.5.0.1 prompt-toolkit: 3.0.7 psutil: 5.7.0 ptyprocess: 0.6.0 pycollada: 0.7.1 pydicom: 2.0.0 Pygments: 2.6.1 PyOpenGL: 3.1.5 PyOpenGL-accelerate: 3.1.5 pyparsing: 2.4.7 PyQt5-commercial: 5.12.3 PyQt5-sip: 4.19.19 PyQtWebEngine-commercial: 5.12.1 python-dateutil: 2.8.1 pytz: 2020.1 pyzmq: 19.0.2 qtconsole: 4.7.4 QtPy: 1.9.0 RandomWords: 0.3.0 requests: 2.24.0 scipy: 1.4.1 Send2Trash: 1.5.0 SEQCROW: 0.24.3 setuptools: 49.4.0 sfftk-rw: 0.6.6.dev0 six: 1.15.0 snowballstemmer: 2.0.0 sortedcontainers: 2.2.2 Sphinx: 3.1.1 sphinxcontrib-applehelp: 1.0.2 sphinxcontrib-blockdiag: 2.0.0 sphinxcontrib-devhelp: 1.0.2 sphinxcontrib-htmlhelp: 1.0.3 sphinxcontrib-jsmath: 1.0.1 sphinxcontrib-qthelp: 1.0.3 sphinxcontrib-serializinghtml: 1.1.4 suds-jurko: 0.6 tables: 3.6.1 tifffile: 2020.6.3 tinyarray: 1.2.2 tornado: 6.0.4 traitlets: 5.0.4 urllib3: 1.25.10 versioneer: 0.18 wcwidth: 0.2.5 webcolors: 1.11.1 wheel: 0.34.2 File attachment: chimerax_wrong_version_display.png
Attachments (1)
Change History (3)
by , 5 years ago
Attachment: | chimerax_wrong_version_display.png added |
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comment:1 by , 5 years ago
Component: | Unassigned → Platform |
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Owner: | set to |
Platform: | → all |
Project: | → ChimeraX |
Status: | new → assigned |
Summary: | ChimeraX bug report submission → Version misreported |
comment:2 by , 5 years ago
I can reproduce this. This is due to the StartupWMClass in the .desktop file being the same for each version. And the last one installed wins.
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