#14691 closed defect (duplicate)

Crash in garbage collection

Reported by: o.bozkurt@… Owned by: pett
Priority: normal Milestone:
Component: Core Version:
Keywords: Cc: Tom Goddard
Blocked By: Blocking:
Notify when closed: Platform: all
Project: ChimeraX

Description

The following bug report has been submitted:
Platform:        macOS-14.3.1-x86_64-i386-64bit
ChimeraX Version: 1.7.1 (2024-01-23 01:58:08 UTC)
Description
Last time you used ChimeraX it crashed.
Please describe steps that led to the crash here.
Fatal Python error: Segmentation fault

Thread 0x0000000314b89000 (most recent call first):
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py", line 324 in wait
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py", line 622 in wait
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py", line 1392 in run
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py", line 1038 in _bootstrap_inner
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/threading.py", line 995 in _bootstrap

Current thread 0x000000020279f240 (most recent call first):
  Garbage-collecting
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/geometry/plane.py", line 44 in __init__
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/atomic/bond_geom.py", line 222 in tetra_pos
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/atomic/bond_geom.py", line 89 in bond_positions
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/addh/hbond.py", line 220 in add_hydrogens
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/addh/cmd.py", line 184 in hbond_add_hydrogens
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/addh/cmd.py", line 77 in cmd_addh
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/coulombic/coulombic.py", line 95 in assign_charges
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/coulombic/cmd.py", line 99 in cmd_coulombic
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/cli.py", line 2908 in run
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/commands/run.py", line 49 in run
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 525 in run
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 582 in run_expanded_command
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 72 in func_plus_tip
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 339 in run
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 420 in run_shortcut
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 402 in try_shortcut
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/shortcuts/shortcuts.py", line 1376 in run_provider
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/shortcuts/__init__.py", line 66 in run_provider
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/toolshed/__init__.py", line 1302 in run_provider
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/toolshed/info.py", line 397 in run_provider
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/toolbar/tool.py", line 205 in callback
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/ui/gui.py", line 275 in event_loop
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py", line 918 in init
  File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py", line 1069 in 
  File "", line 88 in _run_code
  File "", line 198 in _run_module_as_main

Extension modules: chimerax.arrays._arrays, numpy.core._multiarray_umath, numpy.core._multiarray_tests, numpy.linalg._umath_linalg, numpy.fft._pocketfft_internal, numpy.random._common, numpy.random.bit_generator, numpy.random._bounded_integers, numpy.random._mt19937, numpy.random.mtrand, numpy.random._philox, numpy.random._pcg64, numpy.random._sfc64, numpy.random._generator, chimerax.geometry._geometry, PyQt6.QtCore, PyQt6.QtGui, PyQt6.QtWidgets, PyQt6.QtWebChannel, PyQt6.QtNetwork, PyQt6.QtWebEngineCore, PyQt6.QtPrintSupport, PyQt6.QtWebEngineWidgets, chimerax.atomic_lib._load_libs, tinyarray, chimerax.atomic.cymol, chimerax.atomic.cytmpl, chimerax.map._map, charset_normalizer.md, PIL._imaging, matplotlib._c_internal_utils, matplotlib._path, kiwisolver._cext, matplotlib._image, PyQt6.QtOpenGL, PyQt6.QtOpenGLWidgets, OpenGL_accelerate.errorchecker, OpenGL_accelerate.wrapper, OpenGL_accelerate.formathandler, OpenGL_accelerate.arraydatatype, OpenGL_accelerate.latebind, OpenGL_accelerate.vbo, chimerax.surface._surface, lxml._elementpath, lxml.etree, chimerax.pdb_lib._load_libs, PIL._imagingmath, chimerax.core._mac_util, OpenGL_accelerate.numpy_formathandler, OpenGL_accelerate.nones_formathandler, chimerax.pdb._pdbio, chimerax.atomic._ribbons, chimerax.graphics._graphics, chimerax.mmcif._mmcif, chimerax.mmcif.mmcif, chimerax.atom_search.ast, chimerax.chem_group._chem_group, chimerax.coulombic._esp, chimerax.mlp._mlp (total: 59)


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  "procRole" : "Foreground",
  "version" : 2,
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  "codeSigningMonitor" : 1,
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  "procLaunch" : "2024-03-01 21:30:45.6766 +0000",
  "procStartAbsTime" : 199960930758,
  "procExitAbsTime" : 292708274256,
  "procName" : "ChimeraX",
  "procPath" : "\/Applications\/ChimeraX-1.7.1.app\/Contents\/MacOS\/ChimeraX",
  "bundleInfo" : {"CFBundleShortVersionString":"1.7.1","CFBundleVersion":"1.7.1.0","CFBundleIdentifier":"edu.ucsf.cgl.ChimeraX"},
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  "codeSigningID" : "edu.ucsf.cgl.ChimeraX",
  "codeSigningTeamID" : "LWV8X224YF",
  "codeSigningFlags" : 570491649,
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  "sip" : "enabled",
  "vmRegionInfo" : "0xa9 is not in any region.  Bytes before following region: 140722900041559\n      REGION TYPE                    START - END         [ VSIZE] PRT\/MAX SHRMOD  REGION DETAIL\n      UNUSED SPACE AT START\n--->  \n      mapped file              7ffc9a780000-7ffcc3530000 [653.7M] r-x\/r-x SM=COW  ...t_id=b55e5a01",
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  "termination" : {"flags":0,"code":11,"namespace":"SIGNAL","indicator":"Segmentation fault: 11","byProc":"ChimeraX","byPid":6932},
  "vmregioninfo" : "0xa9 is not in any region.  Bytes before following region: 140722900041559\n      REGION TYPE                    START - END         [ VSIZE] PRT\/MAX SHRMOD  REGION DETAIL\n      UNUSED SPACE AT START\n--->  \n      mapped file              7ffc9a780000-7ffcc3530000 [653.7M] r-x\/r-x SM=COW  ...t_id=b55e5a01",
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  "reportNotes" : [
  "PC register does not match crashing frame (0x0 vs 0x7FF8952DEA78)"
]
}
===== Log before crash start =====
Startup Messages  
---  
warning | Replacing fetcher for 'pdb_nmr' and format NMRSTAR from NMRSTAR
bundle with that from NMRSTAR bundle  
  
UCSF ChimeraX version: 1.7.1 (2024-01-23)  
© 2016-2023 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open
> /Users/obozkurt/Downloads/D8674_029218PyrusussuriensisxPyruscommunis_a7342/D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb

Chain information for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb
#1  
---  
Chain | Description  
A B C D E | No description available  
  

> set bgColor white

> select all

7570 atoms, 7635 bonds, 965 residues, 1 model selected  

> hide sel atoms

> show sel cartoons

> lighting soft

> graphics silhouettes true

> coulombic sel

Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_A
SES surface #1.1: minimum, -17.03, mean -1.57, maximum 11.40  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_B
SES surface #1.2: minimum, -26.43, mean -1.58, maximum 11.30  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_C
SES surface #1.3: minimum, -20.67, mean -1.62, maximum 11.55  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_D
SES surface #1.4: minimum, -16.20, mean -1.59, maximum 11.37  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_E
SES surface #1.5: minimum, -32.71, mean -1.59, maximum 13.65  
To also show corresponding color key, enter the above coulombic command and
add key true  

> open
> /Users/obozkurt/Downloads/D8674_029218PyrusussuriensisxPyruscommunis_a7342/D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb

Chain information for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb
#2  
---  
Chain | Description  
A B C D E | No description available  
  

> select clear

> close #2

> mlp

Map values for surface
"D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_A
SES surface": minimum -28.83, mean -3.559, maximum 22.03  
Map values for surface
"D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_B
SES surface": minimum -26.89, mean -3.532, maximum 22.68  
Map values for surface
"D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_C
SES surface": minimum -30.07, mean -3.56, maximum 22.84  
Map values for surface
"D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_D
SES surface": minimum -29.46, mean -3.536, maximum 22.06  
Map values for surface
"D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_E
SES surface": minimum -29.36, mean -3.582, maximum 22  
To also show corresponding color key, enter the above mlp command and add key
true  

> coulombic

Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_A
SES surface #1.1: minimum, -17.03, mean -1.57, maximum 11.40  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_B
SES surface #1.2: minimum, -26.43, mean -1.58, maximum 11.30  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_C
SES surface #1.3: minimum, -20.67, mean -1.62, maximum 11.55  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_D
SES surface #1.4: minimum, -16.20, mean -1.59, maximum 11.37  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_E
SES surface #1.5: minimum, -32.71, mean -1.59, maximum 13.65  
To also show corresponding color key, enter the above coulombic command and
add key true  
Alignment identifier is 1  

> select /A-E:1

40 atoms, 35 bonds, 5 residues, 1 model selected  

> select /A-E:1-49

1845 atoms, 1870 bonds, 245 residues, 1 model selected  

> color (#!1 & sel) black

> select clear

> color bfactor

7570 atoms, 965 residues, 5 surfaces, atom bfactor range 24.3 to 93.3  

> coulombic

Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_A
SES surface #1.1: minimum, -17.03, mean -1.57, maximum 11.40  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_B
SES surface #1.2: minimum, -26.43, mean -1.58, maximum 11.30  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_C
SES surface #1.3: minimum, -20.67, mean -1.62, maximum 11.55  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_D
SES surface #1.4: minimum, -16.20, mean -1.59, maximum 11.37  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_E
SES surface #1.5: minimum, -32.71, mean -1.59, maximum 13.65  
To also show corresponding color key, enter the above coulombic command and
add key true  

> color bynucleotide

> coulombic

Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_A
SES surface #1.1: minimum, -17.03, mean -1.57, maximum 11.40  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_B
SES surface #1.2: minimum, -26.43, mean -1.58, maximum 11.30  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_C
SES surface #1.3: minimum, -20.67, mean -1.62, maximum 11.55  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_D
SES surface #1.4: minimum, -16.20, mean -1.59, maximum 11.37  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_E
SES surface #1.5: minimum, -32.71, mean -1.59, maximum 13.65  
To also show corresponding color key, enter the above coulombic command and
add key true  

> rainbow

> color bypolymer

> color bychain

> color byhetero

> color bychain

> color bypolymer

> rainbow

> coulombic

Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_A
SES surface #1.1: minimum, -17.03, mean -1.57, maximum 11.40  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_B
SES surface #1.2: minimum, -26.43, mean -1.58, maximum 11.30  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_C
SES surface #1.3: minimum, -20.67, mean -1.62, maximum 11.55  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_D
SES surface #1.4: minimum, -16.20, mean -1.59, maximum 11.37  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_E
SES surface #1.5: minimum, -32.71, mean -1.59, maximum 13.65  
To also show corresponding color key, enter the above coulombic command and
add key true  

> mlp

Map values for surface
"D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_A
SES surface": minimum -28.83, mean -3.559, maximum 22.03  
Map values for surface
"D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_B
SES surface": minimum -26.89, mean -3.532, maximum 22.68  
Map values for surface
"D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_C
SES surface": minimum -30.07, mean -3.56, maximum 22.84  
Map values for surface
"D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_D
SES surface": minimum -29.46, mean -3.536, maximum 22.06  
Map values for surface
"D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_E
SES surface": minimum -29.36, mean -3.582, maximum 22  
To also show corresponding color key, enter the above mlp command and add key
true  

> coulombic

Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_A
SES surface #1.1: minimum, -17.03, mean -1.57, maximum 11.40  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_B
SES surface #1.2: minimum, -26.43, mean -1.58, maximum 11.30  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_C
SES surface #1.3: minimum, -20.67, mean -1.62, maximum 11.55  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_D
SES surface #1.4: minimum, -16.20, mean -1.59, maximum 11.37  
Coulombic values for
D8674_029218PyrusussuriensisxPyruscommunis_a7342_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_E
SES surface #1.5: minimum, -32.71, mean -1.59, maximum 13.65  
To also show corresponding color key, enter the above coulombic command and
add key true  

> close

> open
> /Users/obozkurt/Downloads/D8674_029218Pyrus_6X_4bc3d/D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb

Chain information for
D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb
#1  
---  
Chain | Description  
A B C D E F | No description available  
  

> hide atoms

> show cartoons

> coulombic

Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for
D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_A
SES surface #1.1: minimum, -16.28, mean -1.57, maximum 14.88  
Coulombic values for
D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_B
SES surface #1.2: minimum, -16.46, mean -1.58, maximum 11.67  
Coulombic values for
D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_C
SES surface #1.3: minimum, -26.51, mean -1.58, maximum 11.67  
Coulombic values for
D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_D
SES surface #1.4: minimum, -16.41, mean -1.55, maximum 12.05  
Coulombic values for
D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_E
SES surface #1.5: minimum, -16.72, mean -1.58, maximum 11.70  
Coulombic values for
D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_F
SES surface #1.6: minimum, -16.68, mean -1.56, maximum 14.51  
To also show corresponding color key, enter the above coulombic command and
add key true  

> mlp

Map values for surface
"D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_A
SES surface": minimum -28.59, mean -3.514, maximum 22.73  
Map values for surface
"D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_B
SES surface": minimum -28.92, mean -3.513, maximum 23.34  
Map values for surface
"D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_C
SES surface": minimum -28.26, mean -3.455, maximum 22.08  
Map values for surface
"D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_D
SES surface": minimum -27.62, mean -3.463, maximum 21.84  
Map values for surface
"D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_E
SES surface": minimum -29.62, mean -3.49, maximum 21.74  
Map values for surface
"D8674_029218Pyrus_6X_4bc3d_unrelaxed_rank_001_alphafold2_multimer_v3_model_4_seed_000.pdb_F
SES surface": minimum -27.87, mean -3.489, maximum 23.08  
To also show corresponding color key, enter the above mlp command and add key
true  

> open
> /Users/obozkurt/Downloads/RPW81_335dd/RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb

Chain information for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb #2  
---  
Chain | Description  
A B C D E | No description available  
  

> close #1

> hide atoms

> show cartoons

> coulombic

Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_A
SES surface #2.1: minimum, -18.58, mean 0.17, maximum 17.75  
Coulombic values for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_B
SES surface #2.2: minimum, -15.25, mean 0.19, maximum 17.05  
Coulombic values for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_C
SES surface #2.3: minimum, -15.52, mean 0.17, maximum 18.35  
Coulombic values for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_D
SES surface #2.4: minimum, -16.50, mean 0.14, maximum 17.42  
Coulombic values for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_E
SES surface #2.5: minimum, -22.76, mean 0.16, maximum 22.42  
To also show corresponding color key, enter the above coulombic command and
add key true  

> hide cartoons

> show atoms

> hide atoms

> mlp

Map values for surface
"RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_A
SES surface": minimum -27.39, mean -2.52, maximum 25.26  
Map values for surface
"RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_B
SES surface": minimum -27.18, mean -2.512, maximum 25.19  
Map values for surface
"RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_C
SES surface": minimum -27.08, mean -2.49, maximum 25.31  
Map values for surface
"RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_D
SES surface": minimum -27.8, mean -2.463, maximum 26.42  
Map values for surface
"RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_E
SES surface": minimum -27.33, mean -2.558, maximum 25.03  
To also show corresponding color key, enter the above mlp command and add key
true  

> hide surfaces

> show cartoons

> coulombic

Coulombic values for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_A
SES surface #2.1: minimum, -18.58, mean 0.17, maximum 17.75  
Coulombic values for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_B
SES surface #2.2: minimum, -15.25, mean 0.19, maximum 17.05  
Coulombic values for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_C
SES surface #2.3: minimum, -15.52, mean 0.17, maximum 18.35  
Coulombic values for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_D
SES surface #2.4: minimum, -16.50, mean 0.14, maximum 17.42  
Coulombic values for
RPW81_335dd_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_000.pdb_E
SES surface #2.5: minimum, -22.76, mean 0.16, maximum 22.42  
To also show corresponding color key, enter the above coulombic command and
add key true  

> hide surfaces

> color bypolymer

> close

> open
> /Users/obozkurt/Downloads/DAR5_Arabidopsis_5X_a674c/DAR5_Arabidopsis_5X_a674c_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_000.pdb

Chain information for
DAR5_Arabidopsis_5X_a674c_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_000.pdb
#1  
---  
Chain | Description  
A B C D E | No description available  
  

> hide cartoons

> hide atoms

> show cartoons

> close

> open
> /Users/obozkurt/Downloads/LOC112180138_Rosa_chinensis_a919e/LOC112180138_Rosa_chinensis_a919e_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_000.pdb

Chain information for
LOC112180138_Rosa_chinensis_a919e_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_000.pdb
#1  
---  
Chain | Description  
A B C D E | No description available  
  

> hide atoms

> show cartoons

> coulombic


===== Log before crash end =====

Log:
Startup Messages  
---  
warning | Replacing fetcher for 'pdb_nmr' and format NMRSTAR from NMRSTAR
bundle with that from NMRSTAR bundle  
  
UCSF ChimeraX version: 1.7.1 (2024-01-23)  
© 2016-2023 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open
> /Users/obozkurt/Downloads/LOC112180138_Rosa_chinensis_a919e/LOC112180138_Rosa_chinensis_a919e_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_000.pdb

Chain information for
LOC112180138_Rosa_chinensis_a919e_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_000.pdb
#1  
---  
Chain | Description  
A B C D E | No description available  
  




OpenGL version: 4.1 Metal - 88
OpenGL renderer: Apple M3 Max
OpenGL vendor: Apple

Python: 3.11.2
Locale: UTF-8
Qt version: PyQt6 6.3.1, Qt 6.3.1
Qt runtime version: 6.3.2
Qt platform: cocoa
Hardware:

    Hardware Overview:

      Model Name: Mac
      Model Identifier: Mac15,10
      Model Number: MRX53B/A
      Chip: Unknown
      Total Number of Cores: 14 (10 performance and 4 efficiency)
      Memory: 36 GB
      System Firmware Version: 10151.81.1
      OS Loader Version: 10151.81.1

Software:

    System Software Overview:

      System Version: macOS 14.3.1 (23D60)
      Kernel Version: Darwin 23.3.0
      Time since boot: 3 hours, 30 minutes

Graphics/Displays:

    Apple M3 Max:

      Chipset Model: Apple M3 Max
      Type: GPU
      Bus: Built-In
      Total Number of Cores: 30
      Vendor: Apple (0x106b)
      Metal Support: Metal 3
      Displays:
        Color LCD:
          Display Type: Built-in Liquid Retina XDR Display
          Resolution: 3024 x 1964 Retina
          Main Display: Yes
          Mirror: Off
          Online: Yes
          Automatically Adjust Brightness: Yes
          Connection Type: Internal


Installed Packages:
    alabaster: 0.7.16
    appdirs: 1.4.4
    appnope: 0.1.3
    asttokens: 2.4.1
    Babel: 2.14.0
    backcall: 0.2.0
    beautifulsoup4: 4.11.2
    blockdiag: 3.0.0
    blosc2: 2.0.0
    build: 0.10.0
    certifi: 2022.12.7
    cftime: 1.6.3
    charset-normalizer: 3.3.2
    ChimeraX-AddCharge: 1.5.13
    ChimeraX-AddH: 2.2.5
    ChimeraX-AlignmentAlgorithms: 2.0.1
    ChimeraX-AlignmentHdrs: 3.4.1
    ChimeraX-AlignmentMatrices: 2.1
    ChimeraX-Alignments: 2.12.2
    ChimeraX-AlphaFold: 1.0
    ChimeraX-AltlocExplorer: 1.1.1
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Arrays: 1.1
    ChimeraX-Atomic: 1.49.1
    ChimeraX-AtomicLibrary: 12.1.5
    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: 2.0.4
    ChimeraX-BugReporter: 1.0.1
    ChimeraX-BuildStructure: 2.10.5
    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: 1.1
    ChimeraX-CheckWaters: 1.3.2
    ChimeraX-ChemGroup: 2.0.1
    ChimeraX-Clashes: 2.2.4
    ChimeraX-ColorActions: 1.0.3
    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.5.5
    ChimeraX-CommandLine: 1.2.5
    ChimeraX-ConnectStructure: 2.0.1
    ChimeraX-Contacts: 1.0.1
    ChimeraX-Core: 1.7.1
    ChimeraX-CoreFormats: 1.2
    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: 1.1.3
    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: 1.2.2
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.1
    ChimeraX-ImageFormats: 1.2
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.1
    ChimeraX-ItemsInspection: 1.0.1
    ChimeraX-IUPAC: 1.0
    ChimeraX-Label: 1.1.8
    ChimeraX-ListInfo: 1.2.2
    ChimeraX-Log: 1.1.6
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.9.1
    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: 2.1.2
    ChimeraX-MCopy: 1.0
    ChimeraX-MDcrds: 2.6.1
    ChimeraX-MedicalToolbar: 1.0.2
    ChimeraX-Meeting: 1.0.1
    ChimeraX-MLP: 1.1.1
    ChimeraX-mmCIF: 2.12.1
    ChimeraX-MMTF: 2.2
    ChimeraX-Modeller: 1.5.14
    ChimeraX-ModelPanel: 1.4
    ChimeraX-ModelSeries: 1.0.1
    ChimeraX-Mol2: 2.0.3
    ChimeraX-Mole: 1.0
    ChimeraX-Morph: 1.0.2
    ChimeraX-MouseModes: 1.2
    ChimeraX-Movie: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nifti: 1.1
    ChimeraX-NRRD: 1.1
    ChimeraX-Nucleotides: 2.0.3
    ChimeraX-OpenCommand: 1.13.1
    ChimeraX-PDB: 2.7.3
    ChimeraX-PDBBio: 1.0.1
    ChimeraX-PDBLibrary: 1.0.4
    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: 1.1.2
    ChimeraX-RemoteControl: 1.0
    ChimeraX-RenderByAttr: 1.1
    ChimeraX-RenumberResidues: 1.1
    ChimeraX-ResidueFit: 1.0.1
    ChimeraX-RestServer: 1.2
    ChimeraX-RNALayout: 1.0
    ChimeraX-RotamerLibMgr: 4.0
    ChimeraX-RotamerLibsDunbrack: 2.0
    ChimeraX-RotamerLibsDynameomics: 2.0
    ChimeraX-RotamerLibsRichardson: 2.0
    ChimeraX-SaveCommand: 1.5.1
    ChimeraX-SchemeMgr: 1.0
    ChimeraX-SDF: 2.0.2
    ChimeraX-Segger: 1.0
    ChimeraX-Segment: 1.0.1
    ChimeraX-SelInspector: 1.0
    ChimeraX-SeqView: 2.11
    ChimeraX-Shape: 1.0.1
    ChimeraX-Shell: 1.0.1
    ChimeraX-Shortcuts: 1.1.1
    ChimeraX-ShowSequences: 1.0.2
    ChimeraX-SideView: 1.0.1
    ChimeraX-Smiles: 2.1.2
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.12.4
    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: 2.2.2
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-TaskManager: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.1.2
    ChimeraX-ToolshedUtils: 1.2.4
    ChimeraX-Topography: 1.0
    ChimeraX-ToQuest: 1.0
    ChimeraX-Tug: 1.0.1
    ChimeraX-UI: 1.33.3
    ChimeraX-uniprot: 2.3
    ChimeraX-UnitCell: 1.0.1
    ChimeraX-ViewDockX: 1.3.2
    ChimeraX-VIPERdb: 1.0
    ChimeraX-Vive: 1.1
    ChimeraX-VolumeMenu: 1.0.1
    ChimeraX-vrml: 1.0
    ChimeraX-VTK: 1.0
    ChimeraX-WavefrontOBJ: 1.0
    ChimeraX-WebCam: 1.0.2
    ChimeraX-WebServices: 1.1.3
    ChimeraX-Zone: 1.0.1
    colorama: 0.4.6
    comm: 0.2.1
    contourpy: 1.2.0
    cxservices: 1.2.2
    cycler: 0.12.1
    Cython: 0.29.33
    debugpy: 1.8.0
    decorator: 5.1.1
    docutils: 0.19
    executing: 2.0.1
    filelock: 3.9.0
    fonttools: 4.47.2
    funcparserlib: 2.0.0a0
    glfw: 2.6.4
    grako: 3.16.5
    h5py: 3.10.0
    html2text: 2020.1.16
    idna: 3.6
    ihm: 0.38
    imagecodecs: 2023.9.18
    imagesize: 1.4.1
    ipykernel: 6.23.2
    ipython: 8.14.0
    ipython-genutils: 0.2.0
    ipywidgets: 8.1.1
    jedi: 0.18.2
    Jinja2: 3.1.2
    jupyter-client: 8.2.0
    jupyter-core: 5.7.1
    jupyterlab-widgets: 3.0.9
    kiwisolver: 1.4.5
    line-profiler: 4.0.2
    lxml: 4.9.2
    lz4: 4.3.2
    MarkupSafe: 2.1.4
    matplotlib: 3.7.2
    matplotlib-inline: 0.1.6
    msgpack: 1.0.4
    nest-asyncio: 1.6.0
    netCDF4: 1.6.2
    networkx: 3.1
    nibabel: 5.0.1
    nptyping: 2.5.0
    numexpr: 2.8.8
    numpy: 1.25.1
    openvr: 1.23.701
    packaging: 21.3
    ParmEd: 3.4.3
    parso: 0.8.3
    pep517: 0.13.0
    pexpect: 4.9.0
    pickleshare: 0.7.5
    pillow: 10.2.0
    pip: 23.0
    pkginfo: 1.9.6
    platformdirs: 4.1.0
    prompt-toolkit: 3.0.43
    psutil: 5.9.5
    ptyprocess: 0.7.0
    pure-eval: 0.2.2
    py-cpuinfo: 9.0.0
    pycollada: 0.7.2
    pydicom: 2.3.0
    Pygments: 2.16.1
    pynrrd: 1.0.0
    PyOpenGL: 3.1.7
    PyOpenGL-accelerate: 3.1.7
    pyopenxr: 1.0.2801
    pyparsing: 3.0.9
    pyproject-hooks: 1.0.0
    PyQt6-commercial: 6.3.1
    PyQt6-Qt6: 6.3.2
    PyQt6-sip: 13.4.0
    PyQt6-WebEngine-commercial: 6.3.1
    PyQt6-WebEngine-Qt6: 6.3.2
    python-dateutil: 2.8.2
    pytz: 2023.3.post1
    pyzmq: 25.1.2
    qtconsole: 5.4.3
    QtPy: 2.4.1
    RandomWords: 0.4.0
    requests: 2.31.0
    scipy: 1.11.1
    setuptools: 67.4.0
    setuptools-scm: 7.0.5
    sfftk-rw: 0.7.3
    six: 1.16.0
    snowballstemmer: 2.2.0
    sortedcontainers: 2.4.0
    soupsieve: 2.5
    sphinx: 6.1.3
    sphinx-autodoc-typehints: 1.22
    sphinxcontrib-applehelp: 1.0.8
    sphinxcontrib-blockdiag: 3.0.0
    sphinxcontrib-devhelp: 1.0.6
    sphinxcontrib-htmlhelp: 2.0.5
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 1.0.7
    sphinxcontrib-serializinghtml: 1.1.10
    stack-data: 0.6.3
    superqt: 0.5.0
    tables: 3.8.0
    tcia-utils: 1.5.1
    tifffile: 2023.7.18
    tinyarray: 1.2.4
    tomli: 2.0.1
    tornado: 6.4
    traitlets: 5.9.0
    typing-extensions: 4.9.0
    tzdata: 2023.4
    urllib3: 2.1.0
    wcwidth: 0.2.13
    webcolors: 1.12
    wheel: 0.38.4
    wheel-filename: 1.4.1
    widgetsnbextension: 4.0.9

Change History (2)

comment:1 by pett, 20 months ago

Cc: Tom Goddard added
Component: UnassignedCore
Owner: set to pett
Platform: all
Project: ChimeraX
Status: newaccepted
Summary: ChimeraX bug report submissionCrash in garbage collection

comment:2 by pett, 20 months ago

Resolution: duplicate
Status: acceptedclosed
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