Opened 3 years ago
Last modified 3 years ago
#8192 assigned defect
Update coordinates: RuntimeError: Release Object
| 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: Linux-5.15.0-37-generic-x86_64-with-debian-bookworm-sid
ChimeraX Version: 1.1 (2020-09-09 22:22:27 UTC)
Description
(Describe the actions that caused this problem to occur here)
Resolving clashes
Log:
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
> /home/WF/dlmlen001/interpreting_q86rh305kh308kh323kmap/RealSpaceRefine_9/Q86R_afterMDFF-
> Isolde1-coot-4_real_space_refined_004_real_space_refined_001_coot_rotamers_fixed_real_space_refined_009.pdb
Chain information for Q86R_afterMDFF-
Isolde1-coot-4_real_space_refined_004_real_space_refined_001_coot_rotamers_fixed_real_space_refined_009.pdb
#1
---
Chain | Description
A B C E F G H I J K L M N O P Q R S | No description available
> set bgColor white
> open /home/WF/dlmlen001/Downloads/Map4_D1_3_15.mrc
Opened Map4_D1_3_15.mrc, grid size 300,300,300, pixel 1.05, shown at level
0.0246, step 2, values float32
> volume #2 step 1
> ui tool show ISOLDE
> set selectionWidth 4
Chain information for Q86R_afterMDFF-
Isolde1-coot-4_real_space_refined_004_real_space_refined_001_coot_rotamers_fixed_real_space_refined_009.pdb
---
Chain | Description
1.2/A 1.2/B 1.2/C 1.2/E 1.2/F 1.2/G 1.2/H 1.2/I 1.2/J 1.2/K 1.2/L 1.2/M 1.2/N
1.2/O 1.2/P 1.2/Q 1.2/R 1.2/S | No description available
Done loading forcefield
> select all
89174 atoms, 90380 bonds, 5706 residues, 12 models selected
> addh
Summary of feedback from adding hydrogens to Q86R_afterMDFF-
Isolde1-coot-4_real_space_refined_004_real_space_refined_001_coot_rotamers_fixed_real_space_refined_009.pdb
#1.2
---
notes | No usable SEQRES records for Q86R_afterMDFF-
Isolde1-coot-4_real_space_refined_004_real_space_refined_001_coot_rotamers_fixed_real_space_refined_009.pdb
(#1.2) chain A; guessing termini instead
No usable SEQRES records for Q86R_afterMDFF-
Isolde1-coot-4_real_space_refined_004_real_space_refined_001_coot_rotamers_fixed_real_space_refined_009.pdb
(#1.2) chain B; guessing termini instead
No usable SEQRES records for Q86R_afterMDFF-
Isolde1-coot-4_real_space_refined_004_real_space_refined_001_coot_rotamers_fixed_real_space_refined_009.pdb
(#1.2) chain C; guessing termini instead
No usable SEQRES records for Q86R_afterMDFF-
Isolde1-coot-4_real_space_refined_004_real_space_refined_001_coot_rotamers_fixed_real_space_refined_009.pdb
(#1.2) chain E; guessing termini instead
No usable SEQRES records for Q86R_afterMDFF-
Isolde1-coot-4_real_space_refined_004_real_space_refined_001_coot_rotamers_fixed_real_space_refined_009.pdb
(#1.2) chain F; guessing termini instead
13 messages similar to the above omitted
Chain-initial residues that are actual N termini: /A SER 3, /B SER 3, /C SER
3, /E SER 3, /F SER 3, /G SER 3, /H SER 3, /I SER 3, /J SER 3, /K SER 3, /L
SER 3, /M SER 3, /N SER 3, /O SER 3, /P SER 3, /Q SER 3, /R SER 3, /S SER 3
Chain-initial residues that are not actual N termini:
Chain-final residues that are actual C termini:
Chain-final residues that are not actual C termini: /A ILE 319, /B ILE 319, /C
ILE 319, /E ILE 319, /F ILE 319, /G ILE 319, /H ILE 319, /I ILE 319, /J ILE
319, /K ILE 319, /L ILE 319, /M ILE 319, /N ILE 319, /O ILE 319, /P ILE 319,
/Q ILE 319, /R ILE 319, /S ILE 319
3405 hydrogen bonds
/A ILE 319 is not terminus, removing H atom from 'C'
/B ILE 319 is not terminus, removing H atom from 'C'
/C ILE 319 is not terminus, removing H atom from 'C'
/E ILE 319 is not terminus, removing H atom from 'C'
/F ILE 319 is not terminus, removing H atom from 'C'
13 messages similar to the above omitted
36 hydrogens added
> select up
24 atoms, 23 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
18 atoms, 18 bonds, 1 residue, 1 model selected
> select up
18 atoms, 18 bonds, 1 residue, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
16 atoms, 15 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
17 atoms, 16 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
18 atoms, 18 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
18 atoms, 18 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
205 atoms, 204 bonds, 12 residues, 1 model selected
> select up
24 atoms, 23 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
11 atoms, 10 bonds, 1 residue, 1 model selected
> select up
11 atoms, 10 bonds, 1 residue, 1 model selected
> select up
16 atoms, 15 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
11 atoms, 10 bonds, 1 residue, 1 model selected
> select clear
> select up
16 atoms, 15 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
14 atoms, 14 bonds, 1 residue, 1 model selected
> select up
11 atoms, 10 bonds, 1 residue, 1 model selected
> select up
11 atoms, 10 bonds, 1 residue, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
22 atoms, 21 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
132 atoms, 132 bonds, 9 residues, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
22 atoms, 21 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
110 atoms, 109 bonds, 7 residues, 1 model selected
> select up
22 atoms, 21 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
22 atoms, 21 bonds, 1 residue, 1 model selected
> select clear
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select clear
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select clear
> select up
24 atoms, 23 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
12 atoms, 11 bonds, 1 residue, 1 model selected
> select up
12 atoms, 11 bonds, 1 residue, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select clear
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
31 atoms, 30 bonds, 2 residues, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
11 atoms, 10 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
11 atoms, 10 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
24 atoms, 23 bonds, 1 residue, 1 model selected
> select up
24 atoms, 23 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
17 atoms, 17 bonds, 1 residue, 1 model selected
> select up
21 atoms, 21 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
17 atoms, 16 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select clear
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
14 atoms, 13 bonds, 1 residue, 1 model selected
> select up
12 atoms, 11 bonds, 1 residue, 1 model selected
> select up
61 atoms, 61 bonds, 5 residues, 1 model selected
> select down
12 atoms, 11 bonds, 1 residue, 1 model selected
> select up
12 atoms, 11 bonds, 1 residue, 1 model selected
> select up
12 atoms, 11 bonds, 1 residue, 1 model selected
> select up
17 atoms, 16 bonds, 1 residue, 1 model selected
> select up
19 atoms, 18 bonds, 1 residue, 1 model selected
> select up
12 atoms, 11 bonds, 1 residue, 1 model selected
> select clear
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
22 atoms, 21 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
> select up
17 atoms, 16 bonds, 1 residue, 1 model selected
> select up
15 atoms, 14 bonds, 1 residue, 1 model selected
Traceback (most recent call last):
File "/usr/lib/ucsf-chimerax/lib/python3.7/site-
packages/chimerax/core/triggerset.py", line 130, in invoke
return self._func(self._name, data)
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/delayed_reaction.py", line 80, in callback
self.ff(*self.ff_args)
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/openmm/openmm_interface.py", line 1673, in
_update_coordinates_and_repeat
self.atoms.coords = th.coords
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/openmm/openmm_interface.py", line 305, in coords
f(self._c_pointer, n, pointer(coords))
RuntimeError: Release Object
Error processing trigger "new frame":
RuntimeError: Release Object
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/openmm/openmm_interface.py", line 305, in coords
f(self._c_pointer, n, pointer(coords))
See log for complete Python traceback.
Traceback (most recent call last):
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/isolde.py", line 2709, in _start_sim_or_toggle_pause
self.pause_sim_toggle()
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/isolde.py", line 2955, in pause_sim_toggle
self.sim_manager.toggle_pause()
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/openmm/openmm_interface.py", line 720, in
toggle_pause
self.pause = not self.pause
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/openmm/openmm_interface.py", line 699, in pause
self.sim_handler.pause = flag
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/openmm/openmm_interface.py", line 1771, in pause
self._resume()
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/openmm/openmm_interface.py", line 1663, in _resume
self._repeat_step()
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/openmm/openmm_interface.py", line 1654, in
_repeat_step
th.thread_finished, self._update_coordinates_and_repeat, final_args)
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/delayed_reaction.py", line 71, in delayed_reaction
initiator_func(*initiator_args)
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/openmm/openmm_interface.py", line 165, in step
f(self._c_pointer, steps, self._smoothing)
RuntimeError: Release Object
RuntimeError: Release Object
File "/home/WF/dlmlen001/.local/share/ChimeraX/1.1/site-
packages/chimerax/isolde/openmm/openmm_interface.py", line 165, in step
f(self._c_pointer, steps, self._smoothing)
See log for complete Python traceback.
OpenGL version: 3.3.0 NVIDIA 510.73.05
OpenGL renderer: Quadro M5000/PCIe/SSE2
OpenGL vendor: NVIDIA Corporation
Manufacturer: Gigabyte Technology Co., Ltd.
Model: Z390 AORUS PRO WIFI
OS: Ubuntu 22.04 jammy
Architecture: 64bit ELF
CPU: 16 Intel(R) Core(TM) i9-9900K CPU @ 3.60GHz
Cache Size: 16384 KB
Memory:
total used free shared buff/cache available
Mem: 62Gi 7.5Gi 41Gi 41Mi 13Gi 54Gi
Swap: 2.0Gi 0B 2.0Gi
Graphics:
01:00.0 VGA compatible controller [0300]: NVIDIA Corporation TU104 [GeForce RTX 2080 SUPER] [10de:1e81] (rev a1)
Subsystem: NVIDIA Corporation TU104 [GeForce RTX 2080 SUPER] [10de:1e81]
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: 2.1.1
ChimeraX-AlignmentAlgorithms: 2.0
ChimeraX-AlignmentHdrs: 3.2
ChimeraX-AlignmentMatrices: 2.0
ChimeraX-Alignments: 2.1
ChimeraX-Arrays: 1.0
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: 1.0
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-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
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
openvr: 1.12.501
packaging: 20.4
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
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
wcwidth: 0.2.5
webcolors: 1.11.1
wheel: 0.34.2
Change History (2)
comment:1 by , 3 years ago
| Component: | Unassigned → Third Party |
|---|---|
| Owner: | set to |
| Platform: | → all |
| Project: | → ChimeraX |
| Status: | new → assigned |
| Summary: | ChimeraX bug report submission → Update coordinates: RuntimeError: Release Object |
comment:2 by , 3 years ago
I've seen this error reported just three times in 3 years, all in old versions. The "Release Object" error is defined in opencl.hpp, indicating that the error is arising in OpenMM - it's thrown when OpenCL encounters an error trying to release an object from GPU memory. Will chase up with the OpenMM team, but meanwhile I'd strongly suggest updating to ChimeraX/ISOLDE 1.5.
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