Opened 6 years ago
Closed 6 years ago
#3119 closed defect (duplicate)
pseudobond's atoms pb_scene_coord is None(?)
| Reported by: | Owned by: | Tom Goddard | |
|---|---|---|---|
| Priority: | normal | Milestone: | |
| Component: | Graphics | Version: | |
| Keywords: | Cc: | ||
| Blocked By: | Blocking: | ||
| Notify when closed: | Platform: | all | |
| Project: | ChimeraX |
Description
The following bug report has been submitted:
Platform: Darwin-19.4.0-x86_64-i386-64bit
ChimeraX Version: 0.94 (2020-04-14)
Description
(Describe the actions that caused this problem to occur here)
Log:
UCSF ChimeraX version: 0.94.dev202004140658 (2020-04-14)
© 2016-2020 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
> open 3ZBF format mmCIF fromDatabase pdb
3zbf title:
Structure of Human ROS1 Kinase Domain in Complex with Crizotinib [more
info...]
Chain information for 3zbf #1
---
Chain | Description
A | proto-oncogene tyrosine-protein kinase ros
Non-standard residues in 3zbf #1
---
VGH —
3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-yl-1H-pyrazol-4-yl)pyridin-2-amine
(crizotinib)
> preset cartoons/nucleotides ribbons/slabs
Changed 0 atom styles
Preset expands to these ChimeraX commands:
show nucleic
hide protein|solvent|H
surf hide
style (protein|nucleic|solvent) & @@draw_mode=0 stick
cartoon
cartoon style modeh def arrows t arrowshelix f arrowscale 2 wid 2 thick 0.4 sides 12 div 20
cartoon style ~(nucleic|strand) x round
cartoon style (nucleic|strand) x rect
nucleotides tube/slab shape box
> preset "initial styles" "original look"
Preset implemented in Python; no expansion to individual ChimeraX commands
available.
> select ::name="HOH"::name="VGH"
167 atoms, 33 bonds, 1 model selected
> delete atoms sel
> delete bonds sel
> color bynucleotide
> color bynucleotide
> select /A
2260 atoms, 2311 bonds, 2 pseudobonds, 2 models selected
> rainbow sel
> preset "initial styles" "original look"
Preset implemented in Python; no expansion to individual ChimeraX commands
available.
> undo
> redo
> select
2260 atoms, 2311 bonds, 2 pseudobonds, 2 models selected
> undo
> preset cartoons/nucleotides ribbons/slabs
Changed 0 atom styles
Preset expands to these ChimeraX commands:
show nucleic
hide protein|solvent|H
surf hide
style (protein|nucleic|solvent) & @@draw_mode=0 stick
cartoon
cartoon style modeh def arrows t arrowshelix f arrowscale 2 wid 2 thick 0.4 sides 12 div 20
cartoon style ~(nucleic|strand) x round
cartoon style (nucleic|strand) x rect
nucleotides tube/slab shape box
> preset "initial styles" cartoon
Preset implemented in Python; no expansion to individual ChimeraX commands
available.
> nucleotides sel atoms
> style nucleic & sel stick
Changed 0 atom styles
> nucleotides sel atoms
> style nucleic & sel stick
Changed 0 atom styles
> nucleotides sel atoms
> style nucleic & sel stick
Changed 0 atom styles
> show sel atoms
> show sel cartoons
> show sel cartoons
> show sel surfaces
> hide sel surfaces
> hide sel cartoons
> hide sel cartoons
> show sel cartoons
> show sel cartoons
> show sel cartoons
> hide sel cartoons
> show sel cartoons
> ~select #1
1 model selected
> select #1
2260 atoms, 2311 bonds, 2 pseudobonds, 2 models selected
> ~select #1
1 model selected
> color bychain
> color bychain
> rainbow
> hbonds
The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /A ARG 2230 N
263 hydrogen bonds found
> hide atoms
> show atoms
> hide atoms
> show atoms
> preset "initial styles" cartoon
Preset implemented in Python; no expansion to individual ChimeraX commands
available.
> undo
> rainbow
> select
2260 atoms, 2311 bonds, 265 pseudobonds, 3 models selected
> show sel atoms
> hide sel surfaces
> preset "initial styles" cartoon
Preset implemented in Python; no expansion to individual ChimeraX commands
available.
> rainbow sel
> show sel atoms
> hbonds sel
The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /A ARG 2230 N
263 hydrogen bonds found
> hbonds sel
The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /A ARG 2230 N
263 hydrogen bonds found
> hbonds sel
The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /A ARG 2230 N
263 hydrogen bonds found
> hbonds sel
The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /A ARG 2230 N
263 hydrogen bonds found
> hbonds sel
The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: /A ARG 2230 N
263 hydrogen bonds found
> preset "molecular surfaces" "ghostly white"
Changed 0 atom styles
Preset expands to these ChimeraX commands:
style (protein|nucleic|solvent) & @@draw_mode=0 stick
surface
color white targ s trans 80
> toolshed show ViewDockX
No suitable models found for ViewDockX
> preset "overall look" publication
Preset expands to these ChimeraX commands:
set bg white
graphics silhouettes t
> select
2260 atoms, 2311 bonds, 265 pseudobonds, 3 models selected
> ~select #1
1 model selected
> set bgColor black
> set bgColor white
Empty filename passed to function
Empty filename passed to function
> save2 "/Users/jf119/Downloads/ROS1_no criz.pdb"
> open2 /Users/jf119/Desktop/ROS1_ATP.pdb
> close session
> open2 "/Users/jf119/Desktop/ROS1 ATP/ROS1 ATP V1.pdb"
Chain information for ROS1 ATP V1.pdb #1
---
Chain | Description
A | No description available
> open2 "/Users/jf119/Desktop/ROS1 ATP/ROS1_model 1.pdb"
> open2 "/Users/jf119/Desktop/ROS1 ATP/ROS1_model 7.pdb"
> hide #3 models
> show #3 models
> hide #3 models
> show #3 models
> hide #3 models
> show #3 models
> undo
> show #3 models
> select #1/A
2753 atoms, 2804 bonds, 4 pseudobonds, 2 models selected
> select clear
> select clear
> hide #3 models
> show #3 models
> select #1/A
2753 atoms, 2804 bonds, 4 pseudobonds, 2 models selected
> select ~sel
84 atoms, 88 bonds, 2 models selected
> delete atoms sel
> delete bonds sel
> open2 "/Users/jf119/Desktop/ROS1 ATP/ROS1_model 1.pdb"
> cartoon
> select #1/A
2753 atoms, 2804 bonds, 4 pseudobonds, 2 models selected
> cartoon style sel xsection oval modeHelix default
> cartoon sel
> show (sel-residues & sidechain) target ab
> cartoon style sel xsection rectangle modeHelix default
> cartoon style sel xsection oval modeHelix default
> cartoon style sel xsection rectangle modeHelix default
> preset "molecular surfaces" "ghostly white"
Changed 0 atom styles
Preset expands to these ChimeraX commands:
style (protein|nucleic|solvent) & @@draw_mode=0 stick
surface
color white targ s trans 80
> show (sel-residues & sidechain) target ab
> hide sel target a
> preset "initial styles" cartoon
Preset implemented in Python; no expansion to individual ChimeraX commands
available.
> preset "molecular surfaces" "ghostly white"
Changed 0 atom styles
Preset expands to these ChimeraX commands:
style (protein|nucleic|solvent) & @@draw_mode=0 stick
surface
color white targ s trans 80
> preset "initial styles" cartoon
Preset implemented in Python; no expansion to individual ChimeraX commands
available.
> preset "initial styles" "space-filling (chain colors)"
Preset implemented in Python; no expansion to individual ChimeraX commands
available.
> preset "initial styles" "space-filling (single color)"
Preset implemented in Python; no expansion to individual ChimeraX commands
available.
> preset "molecular surfaces" "ghostly white"
Changed 2753 atom styles
Preset expands to these ChimeraX commands:
style (protein|nucleic|solvent) & @@draw_mode=0 stick
surface
color white targ s trans 80
> preset "initial styles" cartoon
Preset implemented in Python; no expansion to individual ChimeraX commands
available.
> preset "molecular surfaces" "ghostly white"
Changed 0 atom styles
Preset expands to these ChimeraX commands:
style (protein|nucleic|solvent) & @@draw_mode=0 stick
surface
color white targ s trans 80
> rainbow sel
> color sel bynucleotide
> mlp sel
Map values for surface "ROS1 ATP V1.pdb_A SES surface": minimum -29.32, mean
-3.722, maximum 22.64
> select clear
> toolshed show Rotamers
No residues selected
Alignment identifier is 1.A
> toolshed show Rotamers
> show (sel-residues & sidechain) target ab
> toolshed show Rotamers
> swapaa interactive sel GLY rotLib Richardson.mode
> swapaa sel GLY rotLib Richardson.mode
Using Richardson.mode library
Swapping ROS1 ATP V1.pdb #1/A SER 1953 to GLY
> toolshed show Rotamers
> swapaa interactive sel SER rotLib Richardson.mode
ROS1 ATP V1.pdb #1/A GLY 1953: phi -128.8, psi none trans
Changed 9 bond radii
> swapaa #1/A:1953 SER criteria 1 rotLib Richardson.mode
Using Richardson.mode library
ROS1 ATP V1.pdb #1/A GLY 1953: phi -128.8, psi none trans
Applying SER rotamer (chi angles: 64.0) to ROS1 ATP V1.pdb #1/A SER 1953
> hbonds sel
The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: ROS1 ATP V1.pdb #1/A ARG 2230 N
0 hydrogen bonds found
> select #1/A
2751 atoms, 2802 bonds, 4 pseudobonds, 2 models selected
> hbonds sel
The following atoms were skipped as donors/acceptors due to missing heavy-atom
bond partners: ROS1 ATP V1.pdb #1/A ARG 2230 N
227 hydrogen bonds found
Traceback (most recent call last):
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/core/triggerset.py", line 130, in invoke
return self._func(self._name, data)
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/pbgroup.py", line 63, in pbg_update
self._update_graphics()
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/pbgroup.py", line 218, in _update_graphics
d.positions = self._update_positions(pbonds, bond_atoms)
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/pbgroup.py", line 231, in _update_positions
axyz0, axyz1 = to_pbg*ba1.pb_scene_coords, to_pbg*ba2.pb_scene_coords
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/molarray.py", line 754, in pb_scene_coords
v[i] = a.pb_scene_coord
File "cymol.pyx", line 242, in
chimerax.atomic.cymol.CyAtom.pb_scene_coord.__get__
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/geometry/place.py", line 122, in __mul__
raise TypeError('Cannot multiply Place times "%s"' % str(p))
TypeError: Cannot multiply Place times "None"
Error processing trigger "changes":
TypeError: Cannot multiply Place times "None"
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/geometry/place.py", line 122, in __mul__
raise TypeError('Cannot multiply Place times "%s"' % str(p))
See log for complete Python traceback.
Traceback (most recent call last):
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/core/triggerset.py", line 130, in invoke
return self._func(self._name, data)
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/pbgroup.py", line 185, in _update_graphics_if_needed
self._update_graphics(gc)
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/pbgroup.py", line 218, in _update_graphics
d.positions = self._update_positions(pbonds, bond_atoms)
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/pbgroup.py", line 231, in _update_positions
axyz0, axyz1 = to_pbg*ba1.pb_scene_coords, to_pbg*ba2.pb_scene_coords
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/molarray.py", line 754, in pb_scene_coords
v[i] = a.pb_scene_coord
File "cymol.pyx", line 242, in
chimerax.atomic.cymol.CyAtom.pb_scene_coord.__get__
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/geometry/place.py", line 122, in __mul__
raise TypeError('Cannot multiply Place times "%s"' % str(p))
TypeError: Cannot multiply Place times "None"
Error processing trigger "graphics update":
TypeError: Cannot multiply Place times "None"
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/geometry/place.py", line 122, in __mul__
raise TypeError('Cannot multiply Place times "%s"' % str(p))
See log for complete Python traceback.
> ~select #3
2751 atoms, 2802 bonds, 4 pseudobonds, 3 models selected
> hide #3 models
Traceback (most recent call last):
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/core/triggerset.py", line 130, in invoke
return self._func(self._name, data)
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/pbgroup.py", line 63, in pbg_update
self._update_graphics()
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/pbgroup.py", line 218, in _update_graphics
d.positions = self._update_positions(pbonds, bond_atoms)
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/pbgroup.py", line 231, in _update_positions
axyz0, axyz1 = to_pbg*ba1.pb_scene_coords, to_pbg*ba2.pb_scene_coords
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/atomic/molarray.py", line 754, in pb_scene_coords
v[i] = a.pb_scene_coord
File "cymol.pyx", line 242, in
chimerax.atomic.cymol.CyAtom.pb_scene_coord.__get__
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/geometry/place.py", line 122, in __mul__
raise TypeError('Cannot multiply Place times "%s"' % str(p))
TypeError: Cannot multiply Place times "None"
Error processing trigger "model display changed":
TypeError: Cannot multiply Place times "None"
File
"/private/var/folders/h3/jpj8bdk14xng5pcdjzwhtjt40f6t51/T/AppTranslocation/66F26260-83A1-4E18-A9DB-8C7810C80931/d/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site-
packages/chimerax/geometry/place.py", line 122, in __mul__
raise TypeError('Cannot multiply Place times "%s"' % str(p))
See log for complete Python traceback.
OpenGL version: 4.1 ATI-3.8.24
OpenGL renderer: AMD Radeon Pro 455 OpenGL Engine
OpenGL vendor: ATI Technologies Inc.
Change History (2)
comment:1 by , 6 years ago
| Component: | Unassigned → Graphics |
|---|---|
| Owner: | set to |
| Platform: | → all |
| Project: | → ChimeraX |
| Status: | new → assigned |
| Summary: | ChimeraX bug report submission → pseudobond's atoms pb_scene_coord is None(?) |
comment:2 by , 6 years ago
| Resolution: | → duplicate |
|---|---|
| Status: | assigned → closed |
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Hi Jeremy,
--Eric