Opened 14 months ago
Closed 14 months ago
#15933 closed defect (duplicate)
Crash in garbage collection
| Reported by: | Owned by: | Eric Pettersen | |
|---|---|---|---|
| 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-13.6.9-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
Current thread 0x00007ff8559537c0 (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/atomic/molarray.py", line 161 in
File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/atomic/molarray.py", line 161 in __iter__
File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/atomic/selectors.py", line 356 in _update_select_residues_menu
File "/Applications/ChimeraX-1.7.1.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/atomic/selectors.py", line 242 in
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.pdb_lib._load_libs, chimerax.surface._surface, 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.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.alignment_algs._sw, chimerax.dssp._dssp, chimerax.alignment_algs._nw, PIL._imagingmath (total: 56)
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{
"uptime" : 1000000,
"procRole" : "Foreground",
"version" : 2,
"userID" : 501,
"deployVersion" : 210,
"modelCode" : "iMac18,3",
"coalitionID" : 6325,
"osVersion" : {
"train" : "macOS 13.6.9",
"build" : "22G830",
"releaseType" : "User"
},
"captureTime" : "2024-09-11 14:25:54.6556 -0500",
"incident" : "28534ED4-ACA4-47DF-8ED0-A5362DA5B56D",
"pid" : 43068,
"cpuType" : "X86-64",
"roots_installed" : 0,
"bug_type" : "309",
"procLaunch" : "2024-09-10 13:14:30.8237 -0500",
"procStartAbsTime" : 998534258728418,
"procExitAbsTime" : 1032107983508770,
"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"},
"storeInfo" : {"deviceIdentifierForVendor":"BAA69DD8-6E66-5ED8-B117-1D265EC12598","thirdParty":true},
"parentProc" : "launchd",
"parentPid" : 1,
"coalitionName" : "edu.ucsf.cgl.ChimeraX",
"crashReporterKey" : "77CFA7F5-DC7C-4870-3C7A-6662DF07730E",
"codeSigningID" : "edu.ucsf.cgl.ChimeraX",
"codeSigningTeamID" : "LWV8X224YF",
"codeSigningFlags" : 570491649,
"codeSigningValidationCategory" : 6,
"codeSigningTrustLevel" : 0,
"wakeTime" : 15867,
"sleepWakeUUID" : "4BE83C6F-F6A3-41A7-B4C9-71E11DA744B2",
"sip" : "enabled",
"vmRegionInfo" : "0xa9 is not in any region. Bytes before following region: 140737488211799\n REGION TYPE START - END [ VSIZE] PRT\/MAX SHRMOD REGION DETAIL\n UNUSED SPACE AT START\n---> \n shared memory 7ffffffdd000-7ffffffde000 [ 4K] r-x\/r-x SM=SHM ",
"exception" : {"codes":"0x0000000000000001, 0x00000000000000a9","rawCodes":[1,169],"type":"EXC_BAD_ACCESS","signal":"SIGSEGV","subtype":"KERN_INVALID_ADDRESS at 0x00000000000000a9"},
"termination" : {"flags":0,"code":11,"namespace":"SIGNAL","indicator":"Segmentation fault: 11","byProc":"ChimeraX","byPid":43068},
"vmregioninfo" : "0xa9 is not in any region. Bytes before following region: 140737488211799\n REGION TYPE START - END [ VSIZE] PRT\/MAX SHRMOD REGION DETAIL\n UNUSED SPACE AT START\n---> \n shared memory 7ffffffdd000-7ffffffde000 [ 4K] r-x\/r-x SM=SHM ",
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"faultingThread" : 0,
"threads" : 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"uuid" : "3435a4a4-d0f8-3399-b0ad-49c3635a0f61",
"path" : "\/System\/Library\/Frameworks\/CoreFoundation.framework\/Versions\/A\/CoreFoundation",
"name" : "CoreFoundation",
"CFBundleVersion" : "1979.104"
}
],
"sharedCache" : {
"base" : 140703429025792,
"size" : 21474836480,
"uuid" : "774caf66-b420-37ec-a8ec-8d92014cbfbc"
},
"vmSummary" : "ReadOnly portion of Libraries: Total=1.1G resident=0K(0%) swapped_out_or_unallocated=1.1G(100%)\nWritable regions: Total=2.1G written=0K(0%) resident=0K(0%) swapped_out=0K(0%) unallocated=2.1G(100%)\n\n VIRTUAL REGION \nREGION TYPE SIZE COUNT (non-coalesced) \n=========== ======= ======= \nAccelerate framework 256K 2 \nActivity Tracing 256K 1 \nCG backing stores 6720K 8 \nCG image 2032K 49 \nCG raster data 1072K 1 \nColorSync 264K 30 \nCoreAnimation 5616K 68 \nCoreGraphics 16K 3 \nCoreGraphics (reserved) 16K 2 reserved VM address space (unallocated)\nCoreUI image data 5256K 40 \nFoundation 32K 2 \nKernel Alloc Once 8K 1 \nMALLOC 1.5G 808 \nMALLOC guard page 32K 8 \nMALLOC_LARGE (reserved) 384K 1 reserved VM address space (unallocated)\nMALLOC_NANO (reserved) 128.0M 1 reserved VM address space (unallocated)\nMach message 16K 2 \nOpenGL GLSL 384K 4 \nSTACK GUARD 112K 28 \nStack 157.2M 29 \nStack Guard 56.0M 1 \nVM_ALLOCATE 288.6M 231 \nVM_ALLOCATE (reserved) 32.0M 1 reserved VM address space (unallocated)\n__CTF 824 1 \n__DATA 49.0M 774 \n__DATA_CONST 52.3M 401 \n__DATA_DIRTY 1812K 229 \n__FONT_DATA 2352 1 \n__GLSLBUILTINS 5174K 1 \n__INFO_FILTER 8 1 \n__LINKEDIT 203.2M 151 \n__OBJC_RO 66.3M 1 \n__OBJC_RW 2013K 2 \n__TEXT 931.1M 779 \ndyld private memory 420K 4 \nmapped file 251.5M 66 \nshared memory 3032K 37 \n=========== ======= ======= \nTOTAL 3.7G 3769 \nTOTAL, minus reserved VM space 3.6G 3769 \n",
"legacyInfo" : {
"threadTriggered" : {
"name" : "CrBrowserMain",
"queue" : "com.apple.main-thread"
}
},
"logWritingSignature" : "02eb6428faed1687b5d3b48a8b662f62b419b591",
"trialInfo" : {
"rollouts" : [
{
"rolloutId" : "5fb4245a1bbfe8005e33a1e1",
"factorPackIds" : {
},
"deploymentId" : 240000021
},
{
"rolloutId" : "6425c75e4327780c10cc4252",
"factorPackIds" : {
"SIRI_HOME_AUTOMATION_INTENT_SELECTION_CACHE" : "642600a457e7664b1698eb32"
},
"deploymentId" : 240000004
}
],
"experiments" : [
{
"treatmentId" : "c47ab4cc-c9c3-4b5d-a87c-e2433ce02597",
"experimentId" : "6639bc6ba73d460582162323",
"deploymentId" : 400000006
},
{
"treatmentId" : "45f4e2a5-551b-4bc2-a2dc-19c244dda8f8",
"experimentId" : "6643969b3099cf28e049862f",
"deploymentId" : 400000007
}
]
}
}
===== Log before crash start =====
Startup Messages
---
note | available bundle cache has not been initialized yet
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/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set2/RealSpaceRefine_107/Combine_W15_107_mod-
> coot-2.pdb
Chain information for Combine_W15_107_mod-coot-2.pdb #1
---
Chain | Description
B | No description available
D | No description available
E | No description available
H | No description available
L | No description available
> hide atoms
> show cartoons
> lighting simple
> open 3e6p
3e6p title:
Crystal structure of human meizothrombin desF1 [more info...]
Chain information for 3e6p #2
---
Chain | Description | UniProt
H | Prothrombin | THRB_HUMAN 16-247
L | Prothrombin | THRB_HUMAN 163-415
Non-standard residues in 3e6p #2
---
DFK —
D-phenylalanyl-N-[(1S)-4-{[(Z)-amino(imino)methyl]amino}-1-(chloroacetyl)butyl]-L-prolinamide
(D-phenylalanyl-prolyl-arginyl-chloromethane)
NA — sodium ion
NAG — 2-acetamido-2-deoxy-beta-D-glucopyranose (N-acetyl-beta-D-glucosamine;
2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE)
SO4 — sulfate ion
> ui tool show Matchmaker
> matchmaker #!2 to #1
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker Combine_W15_107_mod-coot-2.pdb, chain H (#1) with 3e6p, chain H
(#2), sequence alignment score = 1228.6
RMSD between 184 pruned atom pairs is 1.233 angstroms; (across all 251 pairs:
1.862)
> open "/Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set4
> /Combine_W15_set4.pdb"
Chain information for Combine_W15_set4.pdb #3
---
Chain | Description
B | No description available
D | No description available
E | No description available
F | No description available
H | No description available
L | No description available
M | No description available
> hide #!1 models
> hide #!2 models
> hide #!3 atoms
> show #!3 cartoons
> open
> /Users/boskostojanovski/Desktop/Phenix/RealSpaceRefine_112/Combine_W15_set4_real_space_refined_112.pdb
Chain information for Combine_W15_set4_real_space_refined_112.pdb #4
---
Chain | Description
B | No description available
D | No description available
E | No description available
F | No description available
H | No description available
L | No description available
M | No description available
> hide #!3 models
> hide #!4 atoms
> show #!4 cartoons
> show #!1 models
> show #!2 models
> hide #!2 models
> hide #!1 models
> show #!2 models
> close #1
> close #2
> close #3
> close #4
> open
> "/Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set3/Combined
> set/Phenix/RealSpaceRefine_111/Combine_W15_set3__real_space_refined_111.pdb"
Chain information for Combine_W15_set3__real_space_refined_111.pdb #1
---
Chain | Description
B | No description available
D | No description available
E | No description available
F | No description available
H | No description available
L | No description available
> hide atoms
> show cartoons
> lighting simple
> select /B
10735 atoms, 11027 bonds, 1 pseudobond, 1325 residues, 2 models selected
> delete atoms (#!1 & sel)
> delete bonds (#!1 & sel)
> select /D
1852 atoms, 1894 bonds, 234 residues, 1 model selected
> delete atoms sel
> delete bonds sel
> select /F
75 atoms, 74 bonds, 10 residues, 1 model selected
> delete atoms sel
> delete bonds sel
> select /E
676 atoms, 692 bonds, 90 residues, 1 model selected
> delete atoms sel
> delete bonds sel
> open "/Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/starting
> map/comp_1348+1349_DEEP_W15.mrc"
Opened comp_1348+1349_DEEP_W15.mrc as #2, grid size 400,400,400, pixel 0.842,
shown at level -0.000637, step 2, values float32
> save /Users/boskostojanovski/Desktop/3e6p_fromset3.pdb relModel #2
> close #1
> open
> /Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set2/RealSpaceRefine_107/Combine_W15_107_mod-
> coot-2.pdb
Chain information for Combine_W15_107_mod-coot-2.pdb #1
---
Chain | Description
B | No description available
D | No description available
E | No description available
H | No description available
L | No description available
> hide atoms
> show cartoons
> hide #!2 models
> select /B
10735 atoms, 11027 bonds, 1 pseudobond, 1325 residues, 2 models selected
> delete atoms (#!1 & sel)
> delete bonds (#!1 & sel)
> select /D
1852 atoms, 1894 bonds, 234 residues, 1 model selected
> delete atoms sel
> delete bonds sel
> select /L
846 atoms, 867 bonds, 1 pseudobond, 107 residues, 2 models selected
> select /E
676 atoms, 692 bonds, 90 residues, 1 model selected
> delete atoms sel
> delete bonds sel
> save "/Users/boskostojanovski/Desktop/MzDES For
> Refinements/3e6p_fromset2.pdb" relModel #2
> open
> "/Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set3/Combined
> set/Coot/Combine_W15_set3_-coot-0.pdb"
Combine_W15_set3_-coot-0.pdb title:
Crystal structure of human thrombin mutant S195A In complex with the
extracellular fragment of human PAR1 [more info...]
Chain information for Combine_W15_set3_-coot-0.pdb #3
---
Chain | Description | UniProt
B | prothrombin |
D | prothrombin |
E | prothrombin |
F | proteinase-activated receptor 1 | PAR1_HUMAN 33-57
H | No description available |
L | No description available |
Non-standard residues in Combine_W15_set3_-coot-0.pdb #3
---
BHD — (BHD)
> hide atoms
> show cartoons
> hide #!3 models
> show #!3 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> show #!1 models
> show #!2 models
> volume #2 step 1
> volume #2 level 0.1
> volume #2 color #b2b2b299
> hide #!1 models
> show #!1 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> hide #!2 models
> show #!2 models
> hide #!2 models
> show #!2 models
> show #!1 models
> hide #!2 models
> show #!2 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> hide #!2 models
> show #!2 models
> open
> /Users/boskostojanovski/Desktop/Phenix/RealSpaceRefine_113/3e6p_fromset3_real_space_refined_113.pdb
Chain information for 3e6p_fromset3_real_space_refined_113.pdb #4
---
Chain | Description
H | No description available
L | No description available
> hide #!3 models
> show #!1 models
> color #4 #ff40ffff
> show #!3 models
> open
> "/Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set3/Combined
> set/Coot/Combine_W15_set3_-coot-1.pdb"
Combine_W15_set3_-coot-1.pdb title:
Crystal structure of human thrombin mutant S195A In complex with the
extracellular fragment of human PAR1 [more info...]
Chain information for Combine_W15_set3_-coot-1.pdb #5
---
Chain | Description | UniProt
B | prothrombin |
D | prothrombin |
E | prothrombin |
F | proteinase-activated receptor 1 | PAR1_HUMAN 33-57
H | No description available |
L | No description available |
Non-standard residues in Combine_W15_set3_-coot-1.pdb #5
---
BHD — (BHD)
> hide atoms
> show cartoons
> hide #!2 models
> hide #!3 models
> hide #!4 models
> show #!3 models
> open
> "/Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set3/Combined
> set/Combine_W15_set3_.pdb"
Combine_W15_set3_.pdb title:
Crystal structure of human thrombin mutant S195A In complex with the
extracellular fragment of human PAR1 [more info...]
Chain information for Combine_W15_set3_.pdb #6
---
Chain | Description | UniProt
B | prothrombin |
D | prothrombin |
E | prothrombin |
F | proteinase-activated receptor 1 | PAR1_HUMAN 33-57
H | No description available |
L | No description available |
Non-standard residues in Combine_W15_set3_.pdb #6
---
BHD — (BHD)
> hide #!1,3,5-6 atoms
> show #!1,3,5-6 cartoons
> hide #!6 models
> show #!6 models
> hide #!6 models
> show #!6 models
> hide #!6 models
> show #!6 models
> hide #!3 models
> hide #!5 models
> show #!2 models
> hide #!6 models
> show #!6 models
> hide #!6 models
> show #!6 models
> hide #!6 models
> show #!6 models
> hide #!6 models
> show #!6 models
> show #!1,6 atoms
> style #!1,6 stick
Changed 19226 atom styles
> hide #!1,6 atoms
> hide #!2 models
> show #!2 models
> hide #!1 models
> show #!1 models
> hide #!2 models
> close #5
> close #4
> close #3
> hide #!6 models
> show #!6 models
> hide #!1 models
> ui tool show "Show Sequence Viewer"
> sequence chain #6/L
Alignment identifier is 6/L
> select #6/L:414G
8 atoms, 7 bonds, 1 residue, 1 model selected
> select #6/L:414G-414L
51 atoms, 51 bonds, 6 residues, 1 model selected
> select #6/L:277
12 atoms, 12 bonds, 1 residue, 1 model selected
> select #6/L:277-286,401,401A,401B,401C,401D,401E,401F,402-414L
347 atoms, 354 bonds, 42 residues, 1 model selected
> select ~sel & ##selected
16003 atoms, 16428 bonds, 3 pseudobonds, 1992 residues, 2 models selected
> delete atoms (#!6 & sel)
> delete bonds (#!6 & sel)
> show #!1 models
> select add #6
347 atoms, 354 bonds, 42 residues, 1 model selected
> ui mousemode right "rotate selected models"
> view matrix models
> #6,0.99863,-0.019385,-0.048518,13.994,0.018601,0.99969,-0.016561,-0.10043,0.048824,0.015636,0.99868,-12.119
> undo
> view matrix models #6,1,0,0,0.61941,0,1,0,1.3359,0,0,1,0.28046
> view matrix models
> #6,0.99955,-0.015978,-0.025472,8.9802,0.015556,0.99974,-0.016709,1.8513,0.025733,0.016305,0.99954,-7.6358
> view matrix models
> #6,0.99987,-0.013824,0.0080505,1.4956,0.01379,0.9999,0.0042047,-2.2161,-0.0081078,-0.0040932,0.99996,2.6223
> view matrix models
> #6,0.99987,-0.013824,0.0080505,1.7307,0.01379,0.9999,0.0042047,-2.1601,-0.0081078,-0.0040932,0.99996,2.7359
> show #!2 models
> hide #!6 models
> show #!6 models
> select subtract #6
Nothing selected
> hide #!6 models
> show #!6 models
> hide #!2 models
> ui tool show "Show Sequence Viewer"
> select add #1
2876 atoms, 2952 bonds, 2 pseudobonds, 358 residues, 2 models selected
> select subtract #1
Nothing selected
> select add #1
2876 atoms, 2952 bonds, 2 pseudobonds, 358 residues, 2 models selected
> select subtract #1
Nothing selected
> hide #!1 models
> show #!1 models
> close #1
> open
> /Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set2/RealSpaceRefine_107/Combine_W15_107_mod-
> coot-2.pdb
Chain information for Combine_W15_107_mod-coot-2.pdb #1
---
Chain | Description
B | No description available
D | No description available
E | No description available
H | No description available
L | No description available
> hide atoms
> show cartoons
> ui tool show "Show Sequence Viewer"
> sequence chain #1/L
Alignment identifier is 1/L
> select #1/L:414L
8 atoms, 7 bonds, 1 residue, 1 model selected
> select #1/L:242-414L
289 atoms, 292 bonds, 1 pseudobond, 34 residues, 2 models selected
> select #1/L:414L
8 atoms, 7 bonds, 1 residue, 1 model selected
> select #1/L:242-414L
289 atoms, 292 bonds, 1 pseudobond, 34 residues, 2 models selected
> select #1/L:414L
8 atoms, 7 bonds, 1 residue, 1 model selected
> select #1/L:247-414L
247 atoms, 249 bonds, 1 pseudobond, 29 residues, 2 models selected
> select #1/L:240
11 atoms, 11 bonds, 1 residue, 1 model selected
> select #1/L:240-242
27 atoms, 28 bonds, 3 residues, 1 model selected
> select #1/L:414K-414L
16 atoms, 15 bonds, 2 residues, 1 model selected
> select #1/L:402-414L
211 atoms, 213 bonds, 25 residues, 1 model selected
> delete atoms sel
> delete bonds sel
> hide #!1 models
> hide #!6 models
> open "/Users/boskostojanovski/Desktop/Models/W15/PDBs for
> Coot/PAR1-coot-3.pdb"
Summary of feedback from opening
/Users/boskostojanovski/Desktop/Models/W15/PDBs for Coot/PAR1-coot-3.pdb
---
warnings | Start residue of secondary structure not found: HELIX 1 1 THR F 34
LEU F 38 1 5
Start residue of secondary structure not found: SHEET 1 1 1 ASP F 39 PRO F 40
0
PAR1-coot-3.pdb title:
Crystal structure of human thrombin mutant S195A In complex with the
extracellular fragment of human PAR1 [more info...]
Chain information for PAR1-coot-3.pdb #3
---
Chain | Description | UniProt
F | proteinase-activated receptor 1 | PAR1_HUMAN 33-57
> show #!2 models
> hide #3 models
> show #!1 models
> hide #!2 models
> show #3 models
> show #!6 models
> show #!2 models
> combine #1,3,6
Remapping chain ID 'L' in Combine_W15_set3_.pdb #6 to 'M'
> hide #!6 models
> hide #3 models
> hide #!2 models
> show #!2 models
> save
> /Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set5/combine_W15_set5.pdb
> models #4 relModel #2
> close #2
> close #1
> close #3
> close #4
> close #6
> open
> /Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set5/combine_W15_set5.pdb
combine_W15_set5.pdb title:
Crystal structure of human thrombin mutant S195A In complex with the
extracellular fragment of human PAR1 [more info...]
Chain information for combine_W15_set5.pdb #1
---
Chain | Description | UniProt
B | prothrombin |
D | prothrombin |
E | prothrombin |
F | proteinase-activated receptor 1 | PAR1_HUMAN 33-57
H | No description available |
L | No description available |
M | No description available |
Non-standard residues in combine_W15_set5.pdb #1
---
BHD — (BHD)
> hide atoms
> show cartoons
> lighting simple
> open
> /Users/boskostojanovski/Desktop/Phenix/RealSpaceRefine_114/combine_W15_set5_real_space_refined_114.pdb
Chain information for combine_W15_set5_real_space_refined_114.pdb #2
---
Chain | Description
B | No description available
D | No description available
E | No description available
F | No description available
H | No description available
L | No description available
M | No description available
> hide atoms
> show cartoons
> hide #!2 models
> show #!2 models
> open "/Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/starting
> map/comp_1348+1349_DEEP_W15.mrc"
Opened comp_1348+1349_DEEP_W15.mrc as #3, grid size 400,400,400, pixel 0.842,
shown at level -0.000637, step 2, values float32
> volume #3 step 1
> volume #3 level 0.1
> volume #3 color #b2b2b299
> hide #!1 models
> show #!1 models
> hide #!1 models
> show #!2 atoms
> style #!2 stick
Changed 16350 atom styles
> hide #!2 atoms
> show #!2 atoms
> hide #!2 atoms
> open
> /Users/boskostojanovski/Desktop/DES_PTse_COOT/0.DEEP_W15/Combine_set5/Coot/combine_W15_set5_real_space_refined_114-coot-0.pdb
Chain information for combine_W15_set5_real_space_refined_114-coot-0.pdb #4
---
Chain | Description
B | No description available
D | No description available
E | No description available
F | No description available
H | No description available
L | No description available
M | No description available
> close #1
> hide #!2 models
> hide #!3 models
> hide #!4 atoms
> show #!4 cartoons
===== Log before crash end =====
Log:
Startup Messages
---
note | available bundle cache has not been initialized yet
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
OpenGL version: 4.1 ATI-4.14.1
OpenGL renderer: AMD Radeon Pro 575 OpenGL Engine
OpenGL vendor: ATI Technologies Inc.
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: iMac
Model Identifier: iMac18,3
Processor Name: Quad-Core Intel Core i5
Processor Speed: 3.5 GHz
Number of Processors: 1
Total Number of Cores: 4
L2 Cache (per Core): 256 KB
L3 Cache: 6 MB
Memory: 16 GB
System Firmware Version: 529.140.2.0.0
OS Loader Version: 577.140.2~22
SMC Version (system): 2.41f2
Software:
System Software Overview:
System Version: macOS 13.6.9 (22G830)
Kernel Version: Darwin 22.6.0
Time since boot: 19 days, 22 hours, 24 minutes
Graphics/Displays:
Radeon Pro 575:
Chipset Model: Radeon Pro 575
Type: GPU
Bus: PCIe
PCIe Lane Width: x16
VRAM (Total): 4 GB
Vendor: AMD (0x1002)
Device ID: 0x67df
Revision ID: 0x00c4
ROM Revision: 113-D000AA-931
VBIOS Version: 113-D0001A1P-025
EFI Driver Version: 01.00.931
Metal Support: Metal 2
Displays:
iMac:
Display Type: Built-In Retina LCD
Resolution: Retina 5K (5120 x 2880)
Framebuffer Depth: 30-Bit Color (ARGB2101010)
Main Display: Yes
Mirror: Off
Online: Yes
Automatically Adjust Brightness: Yes
Connection Type: Internal
LG UltraFine:
Resolution: 3840 x 2160 (2160p/4K UHD 1 - Ultra High Definition)
UI Looks like: 1920 x 1080 @ 60.00Hz
Framebuffer Depth: 30-Bit Color (ARGB2101010)
Display Serial Number: 201NTRLKF070
Mirror: Off
Online: Yes
Rotation: Supported
Automatically Adjust Brightness: Yes
Connection Type: Thunderbolt/DisplayPort
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 , 14 months ago
| Cc: | added |
|---|---|
| Component: | Unassigned → Core |
| Owner: | set to |
| Platform: | → all |
| Project: | → ChimeraX |
| Status: | new → accepted |
| Summary: | ChimeraX bug report submission → Crash in garbage collection |
comment:2 by , 14 months ago
| Resolution: | → duplicate |
|---|---|
| Status: | accepted → closed |
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