Opened 17 months ago

Closed 17 months ago

Last modified 17 months ago

#15331 closed defect (not a bug)

Pbond command

Reported by: aschedlbauer@… Owned by: pett
Priority: normal Milestone:
Component: Structure Editing Version:
Keywords: Cc:
Blocked By: Blocking:
Notify when closed: Platform: all
Project: ChimeraX

Description

The following bug report has been submitted:
Platform:        Linux-4.18.0-348.2.1.el8_5.x86_64-x86_64-with-glibc2.28
ChimeraX Version: 1.7.1 (2024-01-23 01:58:08 UTC)
Description
pbond not working 'unknown command'

example:
pbond #1/A:1601@CL01 #1/A:796@O2' 
output: 'unknown command: pbond'

I could not find any bug report online, any idea?
(https://www.cgl.ucsf.edu/chimerax/docs/user/commands/pbond.html)

Log:
Startup Messages  
---  
warning | Replacing fetcher for 'pdb_nmr' and format NMRSTAR from NMRSTAR
bundle with that from NMRSTAR bundle  
  
You can double click a model's Name or ID in the model panel to edit those
fields  
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 complex3_body_J266.pdb

Chain information for complex3_body_J266.pdb #1  
---  
Chain | Description  
A | No description available  
D | No description available  
E | No description available  
F | No description available  
H | No description available  
K | No description available  
L | No description available  
O | No description available  
P | No description available  
Q | No description available  
R | No description available  
T | No description available  
U | No description available  
  

> set bgColor white

> style stick

Changed 35257 atom styles  

> view #1:1601

> lighting soft

> view #1:1601

> ui tool show "Side View"

> select #1:1601

45 atoms, 46 bonds, 2 residues, 1 model selected  

> show #1:1601

> show #1:@A:1601

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> show #1@A:1601

> show #1@2:32

> getcrd #1@2:32

Atom /1:32@O 237.408 213.349 161.516  
Atom /2:32@K 224.948 251.118 179.276  
Atom /3:32@MG 229.135 183.751 117.370  
Atom /A:32@P 188.564 200.971 133.396  
Atom /A:32@OP1 187.122 200.867 133.725  
Atom /A:32@OP2 188.999 201.043 131.980  
Atom /A:32@O5' 189.149 202.241 134.154  
Atom /A:32@C5' 188.346 202.971 135.063  
Atom /A:32@C4' 188.961 203.027 136.437  
Atom /A:32@O4' 190.344 203.457 136.343  
Atom /A:32@C3' 188.318 204.019 137.390  
Atom /A:32@O3' 187.174 203.482 138.029  
Atom /A:32@C2' 189.451 204.361 138.347  
Atom /A:32@O2' 189.604 203.344 139.325  
Atom /A:32@C1' 190.660 204.317 137.414  
Atom /A:32@N9 190.999 205.636 136.844  
Atom /A:32@C8 191.208 205.871 135.510  
Atom /A:32@N7 191.509 207.107 135.222  
Atom /A:32@C5 191.505 207.736 136.453  
Atom /A:32@C6 191.755 209.066 136.808  
Atom /A:32@N6 192.057 210.008 135.918  
Atom /A:32@N1 191.679 209.395 138.111  
Atom /A:32@C2 191.372 208.440 138.998  
Atom /A:32@N3 191.117 207.149 138.780  
Atom /A:32@C4 191.200 206.850 137.470  
Atom /D:32@N 180.817 240.501 105.792  
Atom /D:32@CA 181.191 240.810 107.167  
Atom /D:32@C 182.502 241.580 107.155  
Atom /D:32@O 183.224 241.609 106.155  
Atom /D:32@CB 181.326 239.544 108.022  
Atom /D:32@SG 182.811 238.568 107.672  
Atom /E:32@N 217.710 249.380 132.915  
Atom /E:32@CA 218.206 249.348 131.556  
Atom /E:32@C 217.785 248.035 130.916  
Atom /E:32@O 217.361 247.093 131.594  
Atom /E:32@CB 219.715 249.519 131.527  
Atom /E:32@OG 220.211 248.861 130.398  
Atom /F:32@N 293.332 201.478 176.475  
Atom /F:32@CA 292.329 200.882 175.606  
Atom /F:32@C 292.752 200.795 174.138  
Atom /F:32@O 291.886 200.544 173.296  
Atom /F:32@CB 291.023 201.666 175.714  
Atom /H:32@N 252.737 197.125 119.519  
Atom /H:32@CA 251.368 197.621 119.382  
Atom /H:32@C 251.375 199.100 119.039  
Atom /H:32@O 250.594 199.561 118.195  
Atom /H:32@CB 250.565 197.379 120.665  
Atom /H:32@CG 249.089 197.814 120.678  
Atom /H:32@CD1 248.353 197.164 119.519  
Atom /H:32@CD2 248.398 197.477 121.993  
Atom /K:32@N 263.961 256.178 191.551  
Atom /K:32@CA 265.383 256.504 191.472  
Atom /K:32@C 265.986 256.284 192.852  
Atom /K:32@O 265.536 256.893 193.831  
Atom /K:32@CB 265.613 257.951 191.008  
Atom /K:32@CG1 267.016 258.114 190.440  
Atom /K:32@CG2 264.555 258.367 189.999  
Atom /L:32@N 186.162 210.248 155.158  
Atom /L:32@CA 186.491 210.439 156.549  
Atom /L:32@C 185.444 211.230 157.305  
Atom /L:32@O 184.600 211.921 156.727  
Atom /O:32@N 267.531 192.065 155.324  
Atom /O:32@CA 266.366 192.583 156.036  
Atom /O:32@C 266.180 191.872 157.370  
Atom /O:32@O 265.909 192.512 158.396  
Atom /O:32@CB 265.114 192.456 155.168  
Atom /O:32@CG 265.045 193.469 154.025  
Atom /O:32@CD1 263.755 193.373 153.211  
Atom /O:32@CD2 265.254 194.889 154.550  
Atom /P:32@N 198.399 174.848 121.868  
Atom /P:32@CA 198.424 173.865 120.788  
Atom /P:32@C 199.848 173.477 120.406  
Atom /P:32@O 200.819 174.142 120.775  
Atom /P:32@CB 197.737 174.441 119.542  
Atom /P:32@CG 198.328 175.751 119.100  
Atom /P:32@CD1 199.340 175.790 118.161  
Atom /P:32@CD2 197.902 176.943 119.661  
Atom /P:32@CE1 199.909 176.999 117.781  
Atom /P:32@CE2 198.464 178.152 119.275  
Atom /P:32@CZ 199.466 178.175 118.331  
Atom /Q:32@N 226.463 193.220 132.924  
Atom /Q:32@CA 225.277 193.625 132.150  
Atom /Q:32@C 225.067 195.128 132.063  
Atom /Q:32@O 224.472 195.584 131.080  
Atom /Q:32@CB 224.111 192.975 132.906  
Atom /Q:32@CG 224.706 192.026 133.837  
Atom /Q:32@CD 226.085 192.480 134.140  
Atom /R:32@N 281.339 237.936 164.404  
Atom /R:32@CA 279.942 237.606 164.156  
Atom /R:32@C 279.066 237.779 165.387  
Atom /R:32@O 277.921 237.306 165.392  
Atom /R:32@CB 279.836 236.178 163.619  
Atom /R:32@CG 280.630 235.995 162.354  
Atom /R:32@CD1 280.171 236.509 161.151  
Atom /R:32@CD2 281.847 235.330 162.361  
Atom /R:32@CE1 280.893 236.358 159.991  
Atom /R:32@CE2 282.578 235.172 161.202  
Atom /R:32@CZ 282.095 235.689 160.019  
Atom /R:32@OH 282.812 235.541 158.854  
Atom /T:32@N 207.228 138.037 150.288  
Atom /T:32@CA 208.562 138.641 150.231  
Atom /T:32@C 209.317 138.379 151.531  
Atom /T:32@O 210.499 137.997 151.533  
Atom /T:32@CB 208.458 140.150 149.947  
Atom /T:32@CG1 207.761 140.398 148.611  
Atom /T:32@CG2 209.836 140.802 149.996  
Atom /T:32@CD1 208.424 139.729 147.453  
Atom /U:32@N 261.487 243.871 175.323  
Atom /U:32@CA 260.667 243.952 176.528  
Atom /U:32@C 259.207 244.194 176.166  
Atom /U:32@O 258.305 243.520 176.675  
Atom /U:32@CB 261.203 245.043 177.471  
Atom /U:32@CG1 260.171 245.386 178.533  
Atom /U:32@CG2 262.498 244.588 178.119  

> view #1:1601

> view #1:1498

[Repeated 1 time(s)]

> view #1:1601

> lighting full

> lighting soft

> lighting flat

> lighting shadows true intensity 0.5

> lighting shadows false

> graphics silhouettes false

> lighting flat

> lighting soft

> ui mousemode right "tape measure"

> ui mousemode right select

> select /A:1601@C15

1 atom, 1 residue, 1 model selected  

> select /A:1601@C21

1 atom, 1 residue, 1 model selected  

> select add /A:1601@N07

2 atoms, 1 residue, 1 model selected  

> select add /A:1601@C22

3 atoms, 1 residue, 1 model selected  

> select add /A:1601@N06

4 atoms, 1 residue, 1 model selected  

> select add /A:1601@C15

5 atoms, 1 residue, 1 model selected  

> ui mousemode right "mark center"

> measure center sel mark true radius 0.3 color cyan

Center of mass of 5 atoms = (234.22, 253.66, 181.10)  

> hide #2 models

> show #2 models

> ui mousemode right select

> select clear

> select #1/A:693@N1

1 atom, 1 residue, 1 model selected  

> select #1/A:693@C6

1 atom, 1 residue, 1 model selected  

> select #1/A:693@N1

1 atom, 1 residue, 1 model selected  

> select add #1/A:693@C6

2 atoms, 1 residue, 1 model selected  

> select add #1/A:693@C5

3 atoms, 1 residue, 1 model selected  

> select add #1/A:693@C4

4 atoms, 1 residue, 1 model selected  

> select add #1/A:693@N3

5 atoms, 1 residue, 1 model selected  

> select add #1/A:693@C2

6 atoms, 1 residue, 1 model selected  

> measure center sel mark true radius 0.3 color cyan

Center of mass of 6 atoms = (237.23, 254.53, 183.02)  

> select clear

[Repeated 1 time(s)]

> select add #1/A:1601@C23

1 atom, 1 residue, 1 model selected  

> select add #1/A:1601@C19

2 atoms, 1 residue, 1 model selected  

> select add #1/A:1601@N08

3 atoms, 1 residue, 1 model selected  

> select add #1/A:1601@C24

4 atoms, 1 residue, 1 model selected  

> select add #1/A:1601@N09

5 atoms, 1 residue, 1 model selected  

> ui mousemode right "mark center"

> marker #2 position 239.3,249.7,177.6 color yellow radius 1

> hide #3 models

> show #3 models

> hide #2 models

> show #2 models

> ui mousemode right "delete markers"

> marker delete #2:2

> ui mousemode right select

> select #2/M:1@M

1 atom, 1 residue, 1 model selected  

> select add #3/M:1@M

2 atoms, 2 residues, 2 models selected  

> select clear

> select #2/M:1

1 atom, 1 residue, 1 model selected  

> ui mousemode right "delete markers"

> distance #2/M:1 #3/M:1

Distance between complex3_body_J266.pdb center 5 atoms #2/M mark 1 M and
complex3_body_J266.pdb center 6 atoms #3/M mark 1 M: 3.673Å  

> hide #3 models

> show #3 models

> hide #4.1 models

> hide #!4 models

> show #!4 models

> hide #2 models

> show #2 models

> distance style #2,3/M color grey

> distance style color grey

> distance style #2,3/M color grey70

Invalid "color" argument: Invalid color name or specifier  

> color #4 #d3d7cfff models

> color #4 #888a85ff models

> color #4 #babdb6ff models

> color #4 #888a85ff models

> marker change #2/M:1 markers false

> marker change #2/M:1 radius 0.0

Traceback (most recent call last):  
File "/usr/libexec/UCSF-ChimeraX/lib/python3.11/site-
packages/chimerax/cmd_line/tool.py", line 319, in execute  
cmd.run(cmd_text)  
File "/usr/libexec/UCSF-ChimeraX/lib/python3.11/site-
packages/chimerax/core/commands/cli.py", line 2908, in run  
result = ci.function(session, **kw_args)  
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^  
File "/usr/libexec/UCSF-ChimeraX/lib/python3.11/site-
packages/chimerax/markers/cmd.py", line 74, in marker_change  
m.radius = radius  
^^^^^^^^  
File "atomic_cpp/cymol.pyx", line 467, in
chimerax.atomic.cymol.CyAtom.radius.__set__  
RuntimeError: radius must be positive  
  
RuntimeError: radius must be positive  
  
File "atomic_cpp/cymol.pyx", line 467, in
chimerax.atomic.cymol.CyAtom.radius.__set__  
  
See log for complete Python traceback.  
  

> marker change #2/M:1 radius 0.01

> marker change #2,3/M:1 radius 0.01

> marker change #2,3/M:1 radius 0.001

> ui mousemode right select

> select #1/A:1601@C23

1 atom, 1 residue, 1 model selected  

> select add #1/A:1601@C19

2 atoms, 1 residue, 1 model selected  

> select add #1/A:1601@N08

3 atoms, 1 residue, 1 model selected  

> select add #1/A:1601@C24

4 atoms, 1 residue, 1 model selected  

> select add #1/A:1601@N09

5 atoms, 1 residue, 1 model selected  

> measure center sel mark true radius 0.3 color cyan modelId 4

Center of mass of 5 atoms = (240.16, 250.14, 177.78)  
Traceback (most recent call last):  
File "/usr/libexec/UCSF-ChimeraX/lib/python3.11/site-
packages/chimerax/cmd_line/tool.py", line 319, in execute  
cmd.run(cmd_text)  
File "/usr/libexec/UCSF-ChimeraX/lib/python3.11/site-
packages/chimerax/core/commands/cli.py", line 2908, in run  
result = ci.function(session, **kw_args)  
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^  
File "/usr/libexec/UCSF-ChimeraX/lib/python3.11/site-
packages/chimerax/std_commands/measure_center.py", line 68, in measure_center  
place_marker(session, xyz, rgba, r, mname, model_id)  
File "/usr/libexec/UCSF-ChimeraX/lib/python3.11/site-
packages/chimerax/std_commands/measure_center.py", line 157, in place_marker  
session.models.add([mset])  
File "/usr/libexec/UCSF-ChimeraX/lib/python3.11/site-
packages/chimerax/core/models.py", line 733, in add  
p = self._parent_for_added_model(model, parent, root_model = root_model)  
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^  
File "/usr/libexec/UCSF-ChimeraX/lib/python3.11/site-
packages/chimerax/core/models.py", line 802, in _parent_for_added_model  
raise ValueError('Tried to add model %s with the same id as another model %s'  
ValueError: Tried to add model complex3_body_J266.pdb center 5 atoms #4 with
the same id as another model distances #4  
  
ValueError: Tried to add model complex3_body_J266.pdb center 5 atoms #4 with
the same id as another model distances #4  
  
File "/usr/libexec/UCSF-ChimeraX/lib/python3.11/site-
packages/chimerax/core/models.py", line 802, in _parent_for_added_model  
raise ValueError('Tried to add model %s with the same id as another model %s'  
  
See log for complete Python traceback.  
  

> measure center sel mark true radius 0.3 color cyan modelId 5

Center of mass of 5 atoms = (240.16, 250.14, 177.78)  

> measure center sel mark true radius 0.3 color cyan modelId 5

Center of mass of 5 atoms = (240.16, 250.14, 177.78)  

> distance #2/M:1 #1/K:129@CB

Distance between complex3_body_J266.pdb center 5 atoms #2/M mark 1 M and
complex3_body_J266.pdb #1/K VAL 129 CB: 11.022Å  

> hide #!4 models

> show #!4 models

> distance delete #1/K:129@CB

> distance delete #2/M:1 #1/K:129@CB

> distance #5/M:1 #1/K:129@CB

Distance between complex3_body_J266.pdb center 5 atoms #5/M mark 1 M and
complex3_body_J266.pdb #1/K VAL 129 CB: 3.690Å  

> select clear

> select #1/A:1-1543

23172 atoms, 25951 bonds, 1 pseudobond, 1078 residues, 2 models selected  

> hbonds /A:1601 restrict /A:1-1543 reveal true

4 hydrogen bonds found  

> ui mousemode right select

> select clear

> select #1/A:1601@O01

1 atom, 1 residue, 1 model selected  

> select #1/A:1601@N08

1 atom, 1 residue, 1 model selected  

> select add #1/A:1601@O01

2 atoms, 1 residue, 1 model selected  

> distance /A:1601@N08 /A:1601@O01 color yellow radius 0.2 dashes 9

Distance between complex3_body_J266.pdb #1/A GE8 1601 N08 and O01: 2.878Å  

> distance /A:1601@N08 /A:1601@O01 color yellow radius 0.1 dashes 9

Distance already exists; modify distance properties with 'distance style'  

> distance style /A:1601@N08 /A:1601@O01 color yellow radius 0.1 dashes 9

> distance style color yellow

> distance style /A:1601@N08 /A:1601@O01 color yellow radius 0.1 dashes 6

> distance style dashes 6

> distance /A:1601@CL01 #1/A:796@O2 color yellow radius 0.1 dashes 9

Distance between complex3_body_J266.pdb #1/A GE8 1601 CL01 and C 796 O2:
5.950Å  

> distance delete /A:1601@CL01 #1/A:796@O2

> distance /A:1601@CL01 #1/A:796@O2' color yellow radius 0.1 dashes 9

Distance between complex3_body_J266.pdb #1/A GE8 1601 CL01 and C 796 O2':
3.630Å  

> select clear

> distance style #5/M:1 #1/K:129@CB color light slate gray

> distance style color lightslategrey

> hide #!4 models

> show #!4 models

> distance delete /A:1601@CL01 #1/A:796@O2'

> pbond /A:1601@CL01 #1/A:796@O2' reveal true color yellow radius 0.1 dashes 6

Unknown command: pbond /A:1601@CL01 #1/A:796@O2' reveal true color yellow
radius 0.1 dashes 6  

> pbond /A:1601@CL01 #1/A:796@O2'

Unknown command: pbond /A:1601@CL01 #1/A:796@O2'  

> pbond /A:1601@CL01 #1/A:796@O2'

Unknown command: pbond /A:1601@CL01 #1/A:796@O2'  

> pbond #2/M:1 #1/K:129@CB

Unknown command: pbond #2/M:1 #1/K:129@CB  

> pbond

Unknown command: pbond  

> distance

Missing or invalid "objects" argument: empty atom specifier  

> pbond

Unknown command: pbond  

> pbonds

Unknown command: pbonds  

> pbond

Unknown command: pbond  

> pbond

Unknown command: pbond  

> pbond

Unknown command: pbond  

> pbond

Unknown command: pbond  




OpenGL version: 3.3.0 NVIDIA 460.84
OpenGL renderer: Quadro K620/PCIe/SSE2
OpenGL vendor: NVIDIA Corporation

Python: 3.11.2
Locale: en_US.UTF-8
Qt version: PyQt6 6.3.1, Qt 6.3.1
Qt runtime version: 6.3.2
Qt platform: xcb

XDG_SESSION_TYPE=x11
DESKTOP_SESSION=gnome
XDG_SESSION_DESKTOP=gnome
XDG_CURRENT_DESKTOP=GNOME
DISPLAY=:1
Manufacturer: Hewlett-Packard
Model: HP Z440 Workstation
OS: CentOS Stream 8 
Architecture: 64bit ELF
Virtual Machine: none
CPU: 8 Intel(R) Xeon(R) CPU E5-1620 v3 @ 3.50GHz
Cache Size: 10240 KB
Memory:
	              total        used        free      shared  buff/cache   available
	Mem:           15Gi        11Gi       338Mi       496Mi       3.4Gi       3.0Gi
	Swap:         7.8Gi       1.4Gi       6.5Gi

Graphics:
	02:00.0 VGA compatible controller [0300]: NVIDIA Corporation GM107GL [Quadro K620] [10de:13bb] (rev a2)	
	Subsystem: Hewlett-Packard Company Device [103c:1098]	
	Kernel driver in use: nvidia

Installed Packages:
    alabaster: 0.7.16
    appdirs: 1.4.4
    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: 2023.11.17
    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-Clipper: 0.22.4
    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-ISOLDE: 1.7.1
    ChimeraX-ItemsInspection: 1.0.1
    ChimeraX-IUPAC: 1.0
    ChimeraX-Label: 1.1.8
    ChimeraX-LinuxSupport: 1.0.1
    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-PhenixUI: 1.2.2
    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
    distro: 1.7.0
    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: 23.2
    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
    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 (3)

comment:1 by pett, 17 months ago

Component: UnassignedStructure Editing
Owner: set to pett
Platform: all
Project: ChimeraX
Status: newaccepted
Summary: ChimeraX bug report submissionPbond command

comment:2 by pett, 17 months ago

Resolution: not a bug
Status: acceptedclosed

Hi Andreas,

The pbond command is not in the 1.7.1 release. You would need to get the 1.8 release candidate to use it. If you access the documentation included with your installed ChimeraX (under its Help menu), that will describe what is available in your installed version. If you search the web, you may find documentation for features that are in newer releases, which is what happened here.

--Eric

Eric Pettersen
UCSF Computer Graphics Lab

comment:3 by aschedlbauer@…, 17 months ago

Dear Eric,

Many thanks for your quick clarification, with kind regards, A.
________________________________
From: ChimeraX <ChimeraX-bugs-admin@cgl.ucsf.edu>
Sent: Wednesday, May 29, 2024 8:07 PM
To: pett@cgl.ucsf.edu <pett@cgl.ucsf.edu>; Andreas Schedlbauer <aschedlbauer@cicbiogune.es>
Subject: Re: [ChimeraX] #15331: Pbond command

CAUTION: This email originated from outside the organization. Do not click links or open attachments unless you recognize the sender and know the content is safe.



#15331: Pbond command
----------------------------------------+--------------------
          Reporter:  aschedlbauer@…     |      Owner:  pett
              Type:  defect             |     Status:  closed
          Priority:  normal             |  Milestone:
         Component:  Structure Editing  |    Version:
        Resolution:  not a bug          |   Keywords:
        Blocked By:                     |   Blocking:
Notify when closed:                     |   Platform:  all
           Project:  ChimeraX           |
----------------------------------------+--------------------
Changes (by pett):

 * resolution:   => not a bug
 * status:  accepted => closed

Comment:

 Hi Andreas,
         The pbond command is not in the 1.7.1 release.  You would need to
 get the 1.8 release candidate to use it.  If you access the documentation
 included with your installed ChimeraX (under its Help menu), that will
 describe what is available in your installed version.  If you search the
 web, you may find documentation for features that are in newer releases,
 which is what happened here.

 --Eric

         Eric Pettersen
         UCSF Computer Graphics Lab
--
Ticket URL: <https://www.rbvi.ucsf.edu/trac/ChimeraX/ticket/15331#comment:2>
ChimeraX <https://www.rbvi.ucsf.edu/chimerax/>
ChimeraX Issue Tracker





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