#14827 closed defect (duplicate)

Crash in garbage collection

Reported by: chimerax-bug-report@… Owned by: Eric Pettersen
Priority: normal Milestone:
Component: Core Version:
Keywords: Cc:
Blocked By: Blocking:
Notify when closed: Platform: all
Project: ChimeraX

Description

The following bug report has been submitted:
Platform:        macOS-13.4-arm64-arm-64bit
ChimeraX Version: 1.6rc202304202331 (2023-04-20 23:31:10 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 0x00000001e88d1e00 (most recent call first):
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/core/serialize.py", line 70 in msgpack_deserialize
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/core/session.py", line 708 in restore
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/core/session.py", line 1004 in open
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/core_formats/__init__.py", line 26 in open
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/open_command/cmd.py", line 435 in remember_data_format
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/open_command/cmd.py", line 465 in collated_open
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/open_command/cmd.py", line 194 in provider_open
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/core/commands/cli.py", line 2897 in run
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/open_command/cmd.py", line 119 in cmd_open
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/core/commands/cli.py", line 2897 in run
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/core/commands/run.py", line 38 in run
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/ui/gui.py", line 1918 in _open_dropped_file
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/ui/gui.py", line 240 in event
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/ui/gui.py", line 275 in event_loop
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/core/__main__.py", line 892 in init
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/site-packages/chimerax/core/__main__.py", line 1043 in 
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/runpy.py", line 87 in _run_code
  File "/Applications/ChimeraX-1.6-rc2023.04.20.app/Contents/Library/Frameworks/Python.framework/Versions/3.9/lib/python3.9/runpy.py", line 197 in _run_module_as_main


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  "procStartAbsTime" : 4315046266494,
  "procExitAbsTime" : 4342585120010,
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  "procPath" : "\/Applications\/ChimeraX-1.6-rc2023.04.20.app\/Contents\/MacOS\/ChimeraX",
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    "path" : "\/Applications\/ChimeraX-1.6-rc2023.04.20.app\/Contents\/Library\/Frameworks\/Python.framework\/Versions\/3.9\/lib\/python3.9\/site-packages\/lxml\/_elementpath.cpython-39-darwin.so",
    "name" : "_elementpath.cpython-39-darwin.so"
  },
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    "arch" : "arm64e",
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    "size" : 237544,
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    "path" : "\/usr\/lib\/system\/libsystem_c.dylib",
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    "path" : "\/usr\/lib\/system\/libsystem_platform.dylib",
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    "size" : 10248192,
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    "name" : "Foundation",
    "CFBundleVersion" : "1977"
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    "size" : 475128,
    "uuid" : "5cda7016-e781-3e53-961c-4978b61c2df1",
    "path" : "\/System\/Library\/Frameworks\/CoreServices.framework\/Versions\/A\/Frameworks\/AE.framework\/Versions\/A\/AE",
    "name" : "AE",
    "CFBundleVersion" : "944"
  },
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    "arch" : "arm64e",
    "base" : 6830202880,
    "CFBundleShortVersionString" : "2.1.1",
    "CFBundleIdentifier" : "com.apple.HIToolbox",
    "size" : 3358720,
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    "path" : "\/System\/Library\/Frameworks\/Carbon.framework\/Versions\/A\/Frameworks\/HIToolbox.framework\/Versions\/A\/HIToolbox",
    "name" : "HIToolbox"
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  {
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    "size" : 582996,
    "uuid" : "bd993f39-c902-37d6-8bd8-6d827c7f121e",
    "path" : "\/usr\/lib\/dyld",
    "name" : "dyld"
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    "size" : 5087232,
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    "name" : "CoreFoundation",
    "CFBundleVersion" : "1977"
  },
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    "source" : "A",
    "base" : 0,
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],
  "sharedCache" : {
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  "vmSummary" : "ReadOnly portion of Libraries: Total=1.6G resident=0K(0%) swapped_out_or_unallocated=1.6G(100%)\nWritable regions: Total=2.7G written=0K(0%) resident=0K(0%) swapped_out=0K(0%) unallocated=2.7G(100%)\n\n                                VIRTUAL   REGION \nREGION TYPE                        SIZE    COUNT (non-coalesced) \n===========                     =======  ======= \nAccelerate framework               256K        2 \nActivity Tracing                   256K        1 \nCG backing stores                 2560K        4 \nCG image                          1472K       67 \nColorSync                          592K       30 \nCoreAnimation                     4256K      113 \nCoreGraphics                        32K        2 \nCoreUI image data                 5392K       42 \nFoundation                          32K        2 \nKernel Alloc Once                   32K        1 \nMALLOC                             1.1G      127 \nMALLOC guard page                  192K       11 \nMALLOC_MEDIUM (reserved)         760.0M        8         reserved VM address space (unallocated)\nMALLOC_NANO (reserved)           384.0M        1         reserved VM address space (unallocated)\nMach message                        64K        3 \nOpenGL GLSL                        384K        4 \nSTACK GUARD                        496K       31 \nStack                            159.2M       32 \nStack Guard                       56.0M        1 \nVM_ALLOCATE                      281.3M      345 \nVM_ALLOCATE (reserved)            64.0M        2         reserved VM address space (unallocated)\n__AUTH                            1849K      373 \n__AUTH_CONST                      28.9M      607 \n__CTF                               824        1 \n__DATA                            20.2M      747 \n__DATA_CONST                      38.9M      756 \n__DATA_DIRTY                      1983K      233 \n__FONT_DATA                        2352        1 \n__GLSLBUILTINS                    5174K        1 \n__INFO_FILTER                         8        1 \n__LINKEDIT                       830.8M      148 \n__OBJC_RO                         66.3M        1 \n__OBJC_RW                         2011K        1 \n__TEXT                           852.2M      776 \ndyld private memory                272K        2 \nmapped file                      568.8M       91 \nshared memory                     3344K       31 \n===========                     =======  ======= \nTOTAL                              5.2G     4599 \nTOTAL, minus reserved VM space     4.0G     4599 \n",
  "legacyInfo" : {
  "threadTriggered" : {
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    "queue" : "com.apple.main-thread"
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},
  "logWritingSignature" : "4599ac4f85ccef4b5b09048d1cfb71ddec7807bc",
  "trialInfo" : {
  "rollouts" : [
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}
}
===== Log before crash start =====
UCSF ChimeraX version: 1.6rc202304202331 (2023-04-20)  
© 2016-2023 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open "/Users/jo_air/Dropbox/CBG LAB/Collaborations/Gallego-
> Bartolome/Results/results_MINU_reduced/results_MINUred_ARP4_ARP7_RTT102/results(18)/best_model.pdb"
> format pdb

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

> color bychain

> ui tool show "Show Sequence Viewer"

> sequence chain /D

Alignment identifier is 1/D  

> select /D:3-12,46-51,123-129

349 atoms, 347 bonds, 23 residues, 1 model selected  

> select /D:24-30,58-66,81-83

369 atoms, 376 bonds, 19 residues, 1 model selected  

> select /D:88

12 atoms, 11 bonds, 1 residue, 1 model selected  

> select /D:1-88

1458 atoms, 1476 bonds, 88 residues, 1 model selected  

> select clear

> select /D:110

7 atoms, 6 bonds, 1 residue, 1 model selected  

> select /D:110-111

17 atoms, 16 bonds, 2 residues, 1 model selected  

> select /D:3-12,46-51,123-129

349 atoms, 347 bonds, 23 residues, 1 model selected  

> select /D:51-52

28 atoms, 27 bonds, 2 residues, 1 model selected  

> select /D:1-52

828 atoms, 839 bonds, 52 residues, 1 model selected  

> select /D:110

7 atoms, 6 bonds, 1 residue, 1 model selected  

> select /D:110

7 atoms, 6 bonds, 1 residue, 1 model selected  

> select /D:21

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select /D:21-71

868 atoms, 881 bonds, 51 residues, 1 model selected  

> select /D:109

14 atoms, 13 bonds, 1 residue, 1 model selected  

> select /D:109-110

21 atoms, 20 bonds, 2 residues, 1 model selected  

> select /D:20

14 atoms, 13 bonds, 1 residue, 1 model selected  

> select /D:20-76

971 atoms, 984 bonds, 57 residues, 1 model selected  

> select coil

6744 atoms, 6737 bonds, 461 residues, 1 model selected  

> close session

> ui tool show AlphaFold

Populating font family aliases took 146 ms. Replace uses of missing font
family "Calibri" with one that exists to avoid this cost.  

QCssParser::parseHexColor: Unknown color name '#0C00'  

> alphafold predict
> MEALVVDAGSKFLKAGAAIPDQSPAMIIPSQMKRMVDDGSSSADNPTTVFEDVTLDPIERGLIRDWDAMEDLLRYVVYTGLGWEEGNEGNILFTDPLCTPKAIREQLVQLMFETFNVSGFYASEQAVLSLYAVGRISGCTVDIGHGKIDIAPVLEGAVQHIASKRFELGGTELTKLFAQELGKTNPSMNLSMSDVEKLKEQYANCAEDEIAYKKTQNCEIEQHTLPDGQVISIGRERYSVGEALFQPSILGLEEHGIVEQLVRIISTVSSENHRQLLENTVLCGGTTSMTGFESRFQKEANLCSSAIRPTLVKPPEYMPENLGMYSAWVGGAILAKVVFPQNQHVTKADYDETGPSVVHRKCF,MDPQTLITKANKVSYYGNPTSKESWRYDWYQPSKVSSNVQQPQQQLGDMENNLEKYPFRYKTWLRNQEDEKNLQRESCEDILDLKEFDRRILKKSLMTSHTKGDTSKATGAPSANQGDEALSVDDIRGAVGNSEAIPGLSAGVNNDNTKESKDVKMN

AlphaFold Service Broken

## AlphaFold Prediction Requires Newer ChimeraX

Alphafold prediction requires a ChimeraX daily build from March 19, 2024 or
later.

The ChimeraX AlphaFold prediction service was broken by an update on Google
Colab on March 14, 2024.

  

> ui tool show Updates

> open "/Users/jo_air/Dropbox/CBG LAB/Collaborations/Orzaez/RMSD.cxs" format
> session

opened ChimeraX session  

> close session

> open "/Users/jo_air/Dropbox/CBG LAB/Collaborations/Gallego-
> Bartolome/Results/results_MINU_reduced/results_MINUred_ARP4_ARP7_RTT102quimeraBDH1/results(19)/best_model.pdb"
> format pdb

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

> color bychain

> open "/Users/jo_air/Dropbox/CBG LAB/Collaborations/Gallego-
> Bartolome/Results/results_MINU_reduced/results_MINUred_ARP4_ARP7_BDH1/best_model.pdb"

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

> close session

> open "/Users/jo_air/Dropbox/CBG LAB/Collaborations/Gallego-
> Bartolome/Results/results_MINU_reduced/results_MINUred_ARP4_ARP7_BDH1/best_model.pdb"

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

> open "/Users/jo_air/Dropbox/CBG LAB/Collaborations/Gallego-
> Bartolome/Results/Matchmaker_BDH1_ARP7_ARP4_to_ARP7_ARP9_Rtt102_2.cxs"


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

Log:
UCSF ChimeraX version: 1.6rc202304202331 (2023-04-20)  
© 2016-2023 Regents of the University of California. All rights reserved.  

> open "/Users/jo_air/Dropbox/CBG LAB/Collaborations/Gallego-
> Bartolome/Results/Matchmaker_BDH1_ARP7_ARP4_to_ARP7_ARP9_Rtt102_2.cxs"

Log from Thu Feb 1 23:40:16 2024UCSF ChimeraX version: 1.6rc202304202331
(2023-04-20)  
© 2016-2023 Regents of the University of California. All rights reserved.  

> open /Users/jo_air/Desktop/BDH1_ARP7_ARP4.cxs format session

Log from Thu Feb 1 12:01:04 2024UCSF ChimeraX version: 1.6rc202304202331
(2023-04-20)  
© 2016-2023 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open /Users/jo_air/Downloads/results(3)/best_model.pdb

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

> select /A

6821 atoms, 6889 bonds, 441 residues, 1 model selected  

> show sel surfaces

> select /B

5560 atoms, 5612 bonds, 363 residues, 1 model selected  

> show sel surfaces

> color (#!1 & sel) light sea green

> select /C

3594 atoms, 3618 bonds, 238 residues, 1 model selected  

> show sel surfaces

> color (#!1 & sel) hot pink

> select clear

> lighting simple

> lighting soft

> color bychain

> coulombic

Using Amber 20 recommended default charges and atom types for standard
residues  
Coulombic values for best_model.pdb_A SES surface #1.1: minimum, -13.04, mean
-1.66, maximum 15.51  
Coulombic values for best_model.pdb_B SES surface #1.2: minimum, -20.82, mean
-3.04, maximum 8.17  
Coulombic values for best_model.pdb_C SES surface #1.3: minimum, -15.53, mean
-1.88, maximum 15.76  
To also show corresponding color key, enter the above coulombic command and
add key true  

> color bychain

> select /C

3594 atoms, 3618 bonds, 238 residues, 1 model selected  

> hide sel surfaces

> select clear

> select /B:118@O

1 atom, 1 residue, 1 model selected  

> select /C:1

19 atoms, 18 bonds, 1 residue, 1 model selected  

> select up

453 atoms, 458 bonds, 29 residues, 2 models selected  

> show sel atoms

> color sel byhetero

> show (#!1 & sel-residues & sidechain) target ab

> nucleotides sel atoms

> style nucleic & sel stick

Changed 0 atom styles  

> style sel stick

Changed 453 atom styles  

> select clear

> select /C:23

7 atoms, 6 bonds, 1 residue, 1 model selected  

> select up

453 atoms, 458 bonds, 29 residues, 2 models selected  

> show sel atoms

> hide sel atoms

> show sel atoms

> select H

7903 atoms, 1042 residues, 1 model selected  

> hide sel atoms

> select clear

> select /C:27

22 atoms, 21 bonds, 1 residue, 1 model selected  

> select up

453 atoms, 458 bonds, 29 residues, 2 models selected  

> ui tool show H-Bonds

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

5 hydrogen bonds found  

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

5 hydrogen bonds found  

> show sel atoms

> transparency (#!1 & sel) 30

> transparency (#!1 & sel) 70

> color sel byhetero

> select clear

> select /C:76

22 atoms, 21 bonds, 1 residue, 1 model selected  

> select up

91 atoms, 94 bonds, 5 residues, 2 models selected  

> show sel atoms

> color sel byhetero

> select H

7903 atoms, 1042 residues, 1 model selected  

> hide (#!1 & sel) target a

> select clear

> select /C:77

24 atoms, 25 bonds, 1 residue, 1 model selected  

> select up

91 atoms, 94 bonds, 5 residues, 2 models selected  

> ui tool show H-Bonds

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

1 hydrogen bonds found  

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

1 hydrogen bonds found  

> transparency (#!1 & sel) 70

> color sel byhetero

> select /C:30

22 atoms, 21 bonds, 1 residue, 1 model selected  

> select up

101 atoms, 103 bonds, 5 residues, 2 models selected  

> show sel atoms

> color sel byhetero

> select H

7903 atoms, 1042 residues, 1 model selected  

> hide (#!1 & sel) target a

> select clear

> select /C:31

22 atoms, 21 bonds, 1 residue, 1 model selected  

> select up

101 atoms, 103 bonds, 5 residues, 2 models selected  

> ui tool show H-Bonds

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

2 hydrogen bonds found  

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

2 hydrogen bonds found  

> transparency (#!1 & sel) 70

> color sel byhetero

> select clear

> select /C:116

21 atoms, 21 bonds, 1 residue, 1 model selected  

> select up

93 atoms, 95 bonds, 5 residues, 2 models selected  

> show sel atoms

> color sel byhetero

> select H

7903 atoms, 1042 residues, 1 model selected  

> hide (#!1 & sel) target a

> select clear

> select /C:115

22 atoms, 21 bonds, 1 residue, 1 model selected  

> select up

93 atoms, 95 bonds, 5 residues, 2 models selected  

> ui tool show H-Bonds

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

5 hydrogen bonds found  

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

5 hydrogen bonds found  

> show sel atoms

> transparency (#!1 & sel) 80

> color sel byhetero

> select clear

> view

> save /Users/jo_air/Desktop/BDH-ARP7-ARP4.tif width 1500 height 1266
> supersample 3 transparentBackground true

> save /Users/jo_air/Desktop/BDH-ARP7-ARP4.tif width 2000 height 1688
> supersample 3 transparentBackground true

> save /Users/jo_air/Desktop/BDH-ARP7-ARP4.png width 3000 height 2531
> supersample 3 transparentBackground true

> save /Users/jo_air/Desktop/BDH-ARP7-ARP4.png width 4000 height 3375
> supersample 3 transparentBackground true

Alignment identifier is 1/A  
Alignment identifier is 1/B  
Alignment identifier is 1/C  

> select /A:119@O

1 atom, 1 residue, 1 model selected  

> view sel

> select clear

> view

> select /C:30

22 atoms, 21 bonds, 1 residue, 1 model selected  

> select up

101 atoms, 103 bonds, 5 residues, 2 models selected  

> ui tool show H-Bonds

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

2 hydrogen bonds found  

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

2 hydrogen bonds found  

> select /C:78

10 atoms, 9 bonds, 1 residue, 1 model selected  

> select up

91 atoms, 94 bonds, 5 residues, 2 models selected  

> ui tool show H-Bonds

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

1 hydrogen bonds found  

> hbonds sel interModel false intraMol false intraRes false select true reveal
> true

1 hydrogen bonds found  

> color sel byhetero

> select /C:32

24 atoms, 25 bonds, 1 residue, 1 model selected  

> select up

101 atoms, 103 bonds, 5 residues, 2 models selected  

> ui tool show H-Bonds

> hbonds sel interModel false intraRes false select true reveal true

8 hydrogen bonds found  

> hbonds sel interModel false intraRes false select true reveal true

8 hydrogen bonds found  

> select clear

> save /Users/jo_air/Desktop/BDH1_ARP7_ARP4.cxs

> coulombic

Coulombic values for best_model.pdb_A SES surface #1.1: minimum, -13.04, mean
-1.66, maximum 15.51  
Coulombic values for best_model.pdb_B SES surface #1.2: minimum, -20.82, mean
-3.04, maximum 8.17  
Coulombic values for best_model.pdb_C SES surface #1.3: minimum, -15.53, mean
-1.88, maximum 15.76  
To also show corresponding color key, enter the above coulombic command and
add key true  

> ui tool show Contacts

> hide surfaces

> show surfaces

> color byhetero

> mlp

Map values for surface "best_model.pdb_A SES surface": minimum -30.64, mean
-5.078, maximum 23.68  
Map values for surface "best_model.pdb_B SES surface": minimum -29.42, mean
-4.612, maximum 24.31  
Map values for surface "best_model.pdb_C SES surface": minimum -26.88, mean
-5.314, maximum 23.39  
To also show corresponding color key, enter the above mlp command and add key
true  

> hide surfaces

> show surfaces

> color bypolymer

> color bychain

> color bypolymer

> color bychain

> color bfactor

15975 atoms, 1042 residues, 3 surfaces, atom bfactor range 14.8 to 98.7  

> hide surfaces

> color bychain

> show surfaces

> select /C

3594 atoms, 3618 bonds, 6 pseudobonds, 238 residues, 2 models selected  

> hide sel surfaces

> color sel byhetero

> select clear

> select /C:10

24 atoms, 23 bonds, 1 residue, 1 model selected  

> select up

453 atoms, 458 bonds, 29 residues, 2 models selected  

> ui tool show Contacts

> contacts sel intraMol false ignoreHiddenModels true select true reveal true

138 contacts  

> contacts sel intraMol false ignoreHiddenModels true select true reveal true

138 contacts  

> transparency (#!1 & sel) 80

> color sel byhetero

> select clear

> select /C:17

14 atoms, 14 bonds, 1 residue, 1 model selected  

> select up

453 atoms, 458 bonds, 29 residues, 2 models selected  

> select H

7903 atoms, 11 pseudobonds, 1042 residues, 2 models selected  

> hide (#!1 & sel) target a

> select clear

> select solvent

Nothing selected  

> select /C:30

22 atoms, 21 bonds, 1 residue, 1 model selected  

> select down

22 atoms, 21 bonds, 1 residue, 2 models selected  

> select up

101 atoms, 103 bonds, 5 residues, 2 models selected  

> select up

3594 atoms, 3618 bonds, 238 residues, 2 models selected  

> select down

101 atoms, 103 bonds, 5 residues, 2 models selected  

> select up

3594 atoms, 3618 bonds, 238 residues, 2 models selected  

> select down

101 atoms, 103 bonds, 5 residues, 2 models selected  

> ui tool show Contacts

> contacts sel intraMol false ignoreHiddenModels true select true reveal true

58 contacts  

> contacts sel intraMol false ignoreHiddenModels true select true reveal true

81 contacts  

> transparency (#!1 & sel) 80

> color sel byhetero

> select /A:23@CE1

1 atom, 1 residue, 1 model selected  

> select clear

> save /Users/jo_air/Desktop/BDH1_ARP7_ARP4.cxs

——— End of log from Thu Feb 1 12:01:04 2024 ———

opened ChimeraX session  

> open /Users/jo_air/Downloads/5tgc.pdb format pdb

5tgc.pdb title:  
Structure of the hetero-trimer of RTT102-ARP7/9 bound to atp [more info...]  
  
Chain information for 5tgc.pdb #2  
---  
Chain | Description | UniProt  
A D | actin-related protein 7 | ARP7_YEAST 1-477  
B E | actin-like protein ARP9 | ARP9_YEAST 1-467  
C F | regulator of TY1 transposition protein 102 | RT102_YEAST 1-157  
  
Non-standard residues in 5tgc.pdb #2  
---  
ATP — adenosine-5'-triphosphate  
SO4 — sulfate ion  
  

> select #2/B

6327 atoms, 6385 bonds, 4 pseudobonds, 397 residues, 2 models selected  

> delete atoms (#!2 & sel)

> delete bonds (#!2 & sel)

> select #2/A

6610 atoms, 6680 bonds, 4 pseudobonds, 408 residues, 2 models selected  

> delete atoms (#!2 & sel)

> delete bonds (#!2 & sel)

> select #2/C

1132 atoms, 1147 bonds, 2 pseudobonds, 67 residues, 2 models selected  

> delete atoms (#!2 & sel)

> delete bonds (#!2 & sel)

> select #2/D:61@CD

1 atom, 1 residue, 1 model selected  

> select add #2

14209 atoms, 14360 bonds, 8 pseudobonds, 883 residues, 2 models selected  

> style sel stick

Changed 14209 atom styles  

> hide sel atoms

> show sel cartoons

> select clear

> save /Users/jo_air/Desktop/homol.cxs

> 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 best_model.pdb, chain A (#1) with 5tgc.pdb, chain D (#2), sequence
alignment score = 524.3  
RMSD between 227 pruned atom pairs is 1.146 angstroms; (across all 372 pairs:
13.451)  
  

> 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 best_model.pdb, chain A (#1) with 5tgc.pdb, chain D (#2), sequence
alignment score = 524.3  
RMSD between 227 pruned atom pairs is 1.146 angstroms; (across all 372 pairs:
13.451)  
  

> select add #1

15975 atoms, 16119 bonds, 89 pseudobonds, 1042 residues, 3 models selected  

> hide sel surfaces

> select clear

> save /Users/jo_air/Desktop/Matchmaker_BDH1_ARP7_ARP4_to_ARP7_ARP9_Rtt102.cxs

> save
> /Users/jo_air/Desktop/Matchmaker_BDH1_ARP7_ARP4_to_ARP7_ARP9_Rtt102_1.png
> width 6000 height 3816 supersample 3 transparentBackground true

> select #1/C:77

24 atoms, 25 bonds, 1 residue, 1 model selected  

> select up

91 atoms, 94 bonds, 5 residues, 2 models selected  

> select up

3594 atoms, 3618 bonds, 238 residues, 2 models selected  

> select down

91 atoms, 94 bonds, 5 residues, 2 models selected  

> view sel

> select clear

> select #1/C:77

24 atoms, 25 bonds, 1 residue, 1 model selected  

> select up

91 atoms, 94 bonds, 5 residues, 2 models selected  

> hide sel atoms

> select #1/C:32

24 atoms, 25 bonds, 1 residue, 1 model selected  

> select up

101 atoms, 103 bonds, 5 residues, 2 models selected  

> hide sel atoms

> select clear

> save
> /Users/jo_air/Desktop/Matchmaker_BDH1_ARP7_ARP4_to_ARP7_ARP9_Rtt102_2.png
> width 6000 height 3816 supersample 3 transparentBackground true

> select clear

> select #1/A

6821 atoms, 6889 bonds, 441 residues, 1 model selected  

> show sel surfaces

> select #1/B

5560 atoms, 5612 bonds, 363 residues, 1 model selected  

> show sel surfaces

> select #1/C

3594 atoms, 3618 bonds, 6 pseudobonds, 238 residues, 2 models selected  

> select #2/E

6270 atoms, 6334 bonds, 3 pseudobonds, 392 residues, 2 models selected  

> show sel surfaces

> select #2/D

6895 atoms, 6967 bonds, 3 pseudobonds, 429 residues, 2 models selected  

> show sel surfaces

> select clear

[Repeated 1 time(s)]

> view

> select clear

[Repeated 1 time(s)]

> save
> /Users/jo_air/Desktop/Matchmaker_BDH1_ARP7_ARP4_to_ARP7_ARP9_Rtt102_3.png
> width 6000 height 3816 supersample 3 transparentBackground true

> select #2/F:29

24 atoms, 25 bonds, 1 residue, 1 model selected  

> select up

126 atoms, 131 bonds, 6 residues, 1 model selected  

> select up

588 atoms, 598 bonds, 36 residues, 1 model selected  

> select down

126 atoms, 131 bonds, 6 residues, 1 model selected  

> view sel

> select clear

[Repeated 1 time(s)]

> transparency 40

> transparency 20

> transparency 0

> save
> /Users/jo_air/Desktop/Matchmaker_BDH1_ARP7_ARP4_to_ARP7_ARP9_Rtt102_4.png
> width 6000 height 3816 supersample 3 transparentBackground true

> save
> /Users/jo_air/Desktop/Matchmaker_BDH1_ARP7_ARP4_to_ARP7_ARP9_Rtt102_2.cxs

——— End of log from Thu Feb 1 23:40:16 2024 ———

opened ChimeraX session  




OpenGL version: 4.1 Metal - 83.1
OpenGL renderer: Apple M2
OpenGL vendor: Apple

Python: 3.9.11
Locale: UTF-8
Qt version: PyQt6 6.4.2, Qt 6.4.2
Qt runtime version: 6.4.3
Qt platform: cocoa
Hardware:

    Hardware Overview:

      Model Name: MacBook Air
      Model Identifier: Mac14,2
      Model Number: Z161000GJY/A
      Chip: Apple M2
      Total Number of Cores: 8 (4 performance and 4 efficiency)
      Memory: 16 GB
      System Firmware Version: 8422.121.1
      OS Loader Version: 8422.121.1

Software:

    System Software Overview:

      System Version: macOS 13.4 (22F66)
      Kernel Version: Darwin 22.5.0
      Time since boot: 4 days, 1 hour, 54 minutes

Graphics/Displays:

    Apple M2:

      Chipset Model: Apple M2
      Type: GPU
      Bus: Built-In
      Total Number of Cores: 10
      Vendor: Apple (0x106b)
      Metal Support: Metal 3
      Displays:
        Color LCD:
          Display Type: Built-in Liquid Retina Display
          Resolution: 2560 x 1664 Retina
          Main Display: Yes
          Mirror: Off
          Online: Yes
          Automatically Adjust Brightness: No
          Connection Type: Internal


Installed Packages:
    alabaster: 0.7.13
    appdirs: 1.4.4
    appnope: 0.1.3
    asttokens: 2.2.1
    Babel: 2.12.1
    backcall: 0.2.0
    beautifulsoup4: 4.11.2
    blockdiag: 3.0.0
    build: 0.10.0
    certifi: 2021.10.8
    cftime: 1.6.2
    charset-normalizer: 3.1.0
    ChimeraX-AddCharge: 1.5.9
    ChimeraX-AddH: 2.2.4
    ChimeraX-AlignmentAlgorithms: 2.0.1
    ChimeraX-AlignmentHdrs: 3.3.1
    ChimeraX-AlignmentMatrices: 2.1
    ChimeraX-Alignments: 2.9.3
    ChimeraX-AlphaFold: 1.0
    ChimeraX-AltlocExplorer: 1.0.3
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Arrays: 1.1
    ChimeraX-Atomic: 1.43.10
    ChimeraX-AtomicLibrary: 10.0.6
    ChimeraX-AtomSearch: 2.0.1
    ChimeraX-AxesPlanes: 2.3.2
    ChimeraX-BasicActions: 1.1.2
    ChimeraX-BILD: 1.0
    ChimeraX-BlastProtein: 2.1.2
    ChimeraX-BondRot: 2.0.1
    ChimeraX-BugReporter: 1.0.1
    ChimeraX-BuildStructure: 2.8
    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.2.2
    ChimeraX-ButtonPanel: 1.0.1
    ChimeraX-CageBuilder: 1.0.1
    ChimeraX-CellPack: 1.0
    ChimeraX-Centroids: 1.3.2
    ChimeraX-ChangeChains: 1.0.2
    ChimeraX-CheckWaters: 1.3.1
    ChimeraX-ChemGroup: 2.0.1
    ChimeraX-Clashes: 2.2.4
    ChimeraX-ColorActions: 1.0.3
    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.5.3
    ChimeraX-CommandLine: 1.2.5
    ChimeraX-ConnectStructure: 2.0.1
    ChimeraX-Contacts: 1.0.1
    ChimeraX-Core: 1.6rc202304202331
    ChimeraX-CoreFormats: 1.1
    ChimeraX-coulombic: 1.4.2
    ChimeraX-Crosslinks: 1.0
    ChimeraX-Crystal: 1.0
    ChimeraX-CrystalContacts: 1.0.1
    ChimeraX-DataFormats: 1.2.3
    ChimeraX-Dicom: 1.2
    ChimeraX-DistMonitor: 1.4
    ChimeraX-DockPrep: 1.1.1
    ChimeraX-Dssp: 2.0
    ChimeraX-EMDB-SFF: 1.0
    ChimeraX-ESMFold: 1.0
    ChimeraX-FileHistory: 1.0.1
    ChimeraX-FunctionKey: 1.0.1
    ChimeraX-Geometry: 1.3
    ChimeraX-gltf: 1.0
    ChimeraX-Graphics: 1.1.1
    ChimeraX-Hbonds: 2.4
    ChimeraX-Help: 1.2.1
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.1
    ChimeraX-ImageFormats: 1.2
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.1
    ChimeraX-ItemsInspection: 1.0.1
    ChimeraX-Label: 1.1.7
    ChimeraX-ListInfo: 1.1.1
    ChimeraX-Log: 1.1.5
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.8.2
    ChimeraX-Map: 1.1.4
    ChimeraX-MapData: 2.0
    ChimeraX-MapEraser: 1.0.1
    ChimeraX-MapFilter: 2.0.1
    ChimeraX-MapFit: 2.0
    ChimeraX-MapSeries: 2.1.1
    ChimeraX-Markers: 1.0.1
    ChimeraX-Mask: 1.0.2
    ChimeraX-MatchMaker: 2.0.12
    ChimeraX-MDcrds: 2.6
    ChimeraX-MedicalToolbar: 1.0.2
    ChimeraX-Meeting: 1.0.1
    ChimeraX-MLP: 1.1.1
    ChimeraX-mmCIF: 2.12
    ChimeraX-MMTF: 2.2
    ChimeraX-Modeller: 1.5.9
    ChimeraX-ModelPanel: 1.3.7
    ChimeraX-ModelSeries: 1.0.1
    ChimeraX-Mol2: 2.0
    ChimeraX-Mole: 1.0
    ChimeraX-Morph: 1.0.2
    ChimeraX-MouseModes: 1.2
    ChimeraX-Movie: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nifti: 1.0
    ChimeraX-NRRD: 1.0
    ChimeraX-Nucleotides: 2.0.3
    ChimeraX-OpenCommand: 1.10.1
    ChimeraX-PDB: 2.7.2
    ChimeraX-PDBBio: 1.0
    ChimeraX-PDBLibrary: 1.0.2
    ChimeraX-PDBMatrices: 1.0
    ChimeraX-PickBlobs: 1.0.1
    ChimeraX-Positions: 1.0
    ChimeraX-PresetMgr: 1.1
    ChimeraX-PubChem: 2.1
    ChimeraX-ReadPbonds: 1.0.1
    ChimeraX-Registration: 1.1.1
    ChimeraX-RemoteControl: 1.0
    ChimeraX-RenderByAttr: 1.1
    ChimeraX-RenumberResidues: 1.1
    ChimeraX-ResidueFit: 1.0.1
    ChimeraX-RestServer: 1.1
    ChimeraX-RNALayout: 1.0
    ChimeraX-RotamerLibMgr: 3.0
    ChimeraX-RotamerLibsDunbrack: 2.0
    ChimeraX-RotamerLibsDynameomics: 2.0
    ChimeraX-RotamerLibsRichardson: 2.0
    ChimeraX-SaveCommand: 1.5.1
    ChimeraX-SchemeMgr: 1.0
    ChimeraX-SDF: 2.0.1
    ChimeraX-Segger: 1.0
    ChimeraX-Segment: 1.0.1
    ChimeraX-SelInspector: 1.0
    ChimeraX-SeqView: 2.8.3
    ChimeraX-Shape: 1.0.1
    ChimeraX-Shell: 1.0.1
    ChimeraX-Shortcuts: 1.1.1
    ChimeraX-ShowSequences: 1.0.1
    ChimeraX-SideView: 1.0.1
    ChimeraX-Smiles: 2.1
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.10.3
    ChimeraX-STL: 1.0.1
    ChimeraX-Storm: 1.0
    ChimeraX-StructMeasure: 1.1.2
    ChimeraX-Struts: 1.0.1
    ChimeraX-Surface: 1.0.1
    ChimeraX-SwapAA: 2.0.1
    ChimeraX-SwapRes: 2.2.1
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.1.2
    ChimeraX-ToolshedUtils: 1.2.1
    ChimeraX-Topography: 1.0
    ChimeraX-Tug: 1.0.1
    ChimeraX-UI: 1.28.4
    ChimeraX-uniprot: 2.2.2
    ChimeraX-UnitCell: 1.0.1
    ChimeraX-ViewDockX: 1.2
    ChimeraX-VIPERdb: 1.0
    ChimeraX-Vive: 1.1
    ChimeraX-VolumeMenu: 1.0.1
    ChimeraX-VTK: 1.0
    ChimeraX-WavefrontOBJ: 1.0
    ChimeraX-WebCam: 1.0.2
    ChimeraX-WebServices: 1.1.1
    ChimeraX-Zone: 1.0.1
    colorama: 0.4.6
    comm: 0.1.3
    contourpy: 1.0.7
    cxservices: 1.2.2
    cycler: 0.11.0
    Cython: 0.29.33
    debugpy: 1.6.7
    decorator: 5.1.1
    docutils: 0.19
    executing: 1.2.0
    filelock: 3.9.0
    fonttools: 4.39.3
    funcparserlib: 1.0.1
    grako: 3.16.5
    h5py: 3.8.0
    html2text: 2020.1.16
    idna: 3.4
    ihm: 0.35
    imagecodecs: 2022.2.22
    imagesize: 1.4.1
    importlib-metadata: 6.6.0
    ipykernel: 6.21.1
    ipython: 8.10.0
    ipython-genutils: 0.2.0
    ipywidgets: 8.0.6
    jedi: 0.18.2
    Jinja2: 3.1.2
    jupyter-client: 8.0.2
    jupyter-core: 5.3.0
    jupyterlab-widgets: 3.0.7
    kiwisolver: 1.4.4
    line-profiler: 4.0.2
    lxml: 4.9.2
    lz4: 4.3.2
    MarkupSafe: 2.1.2
    matplotlib: 3.6.3
    matplotlib-inline: 0.1.6
    msgpack: 1.0.4
    nest-asyncio: 1.5.6
    netCDF4: 1.6.2
    networkx: 2.8.8
    nibabel: 5.0.1
    nptyping: 2.5.0
    numexpr: 2.8.4
    numpy: 1.23.5
    openvr: 1.23.701
    packaging: 21.3
    ParmEd: 3.4.3
    parso: 0.8.3
    pep517: 0.13.0
    pexpect: 4.8.0
    pickleshare: 0.7.5
    Pillow: 9.3.0
    pip: 23.0
    pkginfo: 1.9.6
    platformdirs: 3.2.0
    prompt-toolkit: 3.0.38
    psutil: 5.9.4
    ptyprocess: 0.7.0
    pure-eval: 0.2.2
    pycollada: 0.7.2
    pydicom: 2.3.0
    Pygments: 2.14.0
    pynrrd: 1.0.0
    PyOpenGL: 3.1.5
    PyOpenGL-accelerate: 3.1.5
    pyparsing: 3.0.9
    pyproject-hooks: 1.0.0
    PyQt6-commercial: 6.4.2
    PyQt6-Qt6: 6.4.3
    PyQt6-sip: 13.4.1
    PyQt6-WebEngine-commercial: 6.4.0
    PyQt6-WebEngine-Qt6: 6.4.3
    python-dateutil: 2.8.2
    pytz: 2023.3
    pyzmq: 25.0.2
    qtconsole: 5.4.0
    QtPy: 2.3.1
    RandomWords: 0.4.0
    requests: 2.28.2
    scipy: 1.9.3
    setuptools: 67.4.0
    setuptools-scm: 7.0.5
    sfftk-rw: 0.7.3
    six: 1.16.0
    snowballstemmer: 2.2.0
    sortedcontainers: 2.4.0
    soupsieve: 2.4.1
    sphinx: 6.1.3
    sphinx-autodoc-typehints: 1.22
    sphinxcontrib-applehelp: 1.0.4
    sphinxcontrib-blockdiag: 3.0.0
    sphinxcontrib-devhelp: 1.0.2
    sphinxcontrib-htmlhelp: 2.0.1
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 1.0.3
    sphinxcontrib-serializinghtml: 1.1.5
    stack-data: 0.6.2
    tables: 3.7.0
    tcia-utils: 1.2.0
    tifffile: 2022.10.10
    tinyarray: 1.2.4
    tomli: 2.0.1
    tornado: 6.3.1
    traitlets: 5.9.0
    typing-extensions: 4.5.0
    tzdata: 2023.3
    urllib3: 1.26.15
    wcwidth: 0.2.6
    webcolors: 1.12
    wheel: 0.38.4
    wheel-filename: 1.4.1
    widgetsnbextension: 4.0.7
    zipp: 3.15.0

Change History (2)

comment:1 by Eric Pettersen, 19 months ago

Component: UnassignedCore
Owner: set to Eric Pettersen
Platform: all
Project: ChimeraX
Status: newaccepted
Summary: ChimeraX bug report submissionCrash in garbage collection

comment:2 by Eric Pettersen, 19 months ago

Resolution: duplicate
Status: acceptedclosed
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