Opened 2 years ago
Closed 2 years ago
#9520 closed defect (duplicate)
MemoryError opening mmCIF
| Reported by: | Owned by: | Greg Couch | |
|---|---|---|---|
| Priority: | normal | Milestone: | |
| Component: | Input/Output | Version: | |
| Keywords: | Cc: | ||
| Blocked By: | Blocking: | ||
| Notify when closed: | Platform: | all | |
| Project: | ChimeraX |
Description
The following bug report has been submitted:
Platform: Windows-10-10.0.22621
ChimeraX Version: 1.6.1 (2023-05-09 17:57:07 UTC)
Description
(Describe the actions that caused this problem to occur here)
Log:
UCSF ChimeraX version: 1.6.1 (2023-05-09)
© 2016-2023 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
> open C:/Users/user/Downloads/3aok_final.cif
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-packages\chimerax\ui\gui.py",
line 563, in dropEvent
_open_dropped_file(self.session, p)
File "C:\Program Files\ChimeraX\bin\lib\site-packages\chimerax\ui\gui.py",
line 1918, in _open_dropped_file
run(session, 'open %s' % FileNameArg.unparse(path))
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\run.py", line 38, in run
results = command.run(text, log=log, return_json=return_json)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 119, in cmd_open
models = Command(session, registry=registry).run(provider_cmd_text,
log=log)[0]
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 194, in provider_open
models, status = collated_open(session, None, [data], data_format,
_add_models,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 464, in collated_open
return remember_data_format()
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 435, in remember_data_format
models, status = func(*func_args, **func_kw)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\mmcif\\__init__.py", line 43, in open
return mmcif.open_mmcif(session, data, file_name, **kw)
File "src\mmcif.pyx", line 88, in chimerax.mmcif.mmcif.open_mmcif
MemoryError: not enough memory
MemoryError: not enough memory
File "src\mmcif.pyx", line 88, in chimerax.mmcif.mmcif.open_mmcif
See log for complete Python traceback.
> open C:/Users/user/Downloads/3aok_final.cif
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\dialog.py", line 162, in _qt_safe
run(session, "open " + " ".join([FileNameArg.unparse(p) for p in paths]) + (""
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\run.py", line 38, in run
results = command.run(text, log=log, return_json=return_json)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 119, in cmd_open
models = Command(session, registry=registry).run(provider_cmd_text,
log=log)[0]
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 194, in provider_open
models, status = collated_open(session, None, [data], data_format,
_add_models,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 464, in collated_open
return remember_data_format()
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 435, in remember_data_format
models, status = func(*func_args, **func_kw)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\mmcif\\__init__.py", line 43, in open
return mmcif.open_mmcif(session, data, file_name, **kw)
File "src\mmcif.pyx", line 88, in chimerax.mmcif.mmcif.open_mmcif
MemoryError: not enough memory
MemoryError: not enough memory
File "src\mmcif.pyx", line 88, in chimerax.mmcif.mmcif.open_mmcif
See log for complete Python traceback.
> open C:/Users/user/Downloads/3aok_final.mtz
Install the Clipper bundle to open "MTZ" format files.
Opener for format 'MTZ' is not installed; see log for more info
> open C:/Users/user/Downloads/3aok_final.mtz
Install the Clipper bundle to open "MTZ" format files.
Opener for format 'MTZ' is not installed; see log for more info
> open C:/Users/user/Downloads/3aok_final.cif
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\dialog.py", line 162, in _qt_safe
run(session, "open " + " ".join([FileNameArg.unparse(p) for p in paths]) + (""
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\run.py", line 38, in run
results = command.run(text, log=log, return_json=return_json)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 119, in cmd_open
models = Command(session, registry=registry).run(provider_cmd_text,
log=log)[0]
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 194, in provider_open
models, status = collated_open(session, None, [data], data_format,
_add_models,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 464, in collated_open
return remember_data_format()
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\open_command\cmd.py", line 435, in remember_data_format
models, status = func(*func_args, **func_kw)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\mmcif\\__init__.py", line 43, in open
return mmcif.open_mmcif(session, data, file_name, **kw)
File "src\mmcif.pyx", line 88, in chimerax.mmcif.mmcif.open_mmcif
MemoryError: not enough memory
MemoryError: not enough memory
File "src\mmcif.pyx", line 88, in chimerax.mmcif.mmcif.open_mmcif
See log for complete Python traceback.
> open C:/Users/user/Downloads/3aok_final.cif
Summary of feedback from opening C:/Users/user/Downloads/3aok_final.cif
---
warnings | Expected gap or linking atom in THR /A:2 for ALA /A:1
Expected gap or linking atoms for THR /A:2 and PHE /A:3
Expected gap or linking atom in PHE /A:3 for GLU /A:4
Expected gap or linking atom in ILE /A:5 for GLU /A:4
Expected gap or linking atoms for ILE /A:5 and VAL /A:6
153 messages similar to the above omitted
notes | Fetching CCD THR from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/R/THR/THR.cif
Fetching CCD PHE from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/E/PHE/PHE.cif
Fetching CCD ILE from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/E/ILE/ILE.cif
Fetching CCD VAL from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/L/VAL/VAL.cif
Fetching CCD SER from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/R/SER/SER.cif
Fetching CCD TYR from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/R/TYR/TYR.cif
Fetching CCD TRP from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/P/TRP/TRP.cif
Fetching CCD LYS from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/S/LYS/LYS.cif
Fetching CCD LEU from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/U/LEU/LEU.cif
Fetching CCD PRO from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/O/PRO/PRO.cif
Fetching CCD MET from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/T/MET/MET.cif
Fetching CCD TLA from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/A/TLA/TLA.cif
Fetching CCD GOL from
https://files.wwpdb.org/pub/pdb/refdata/chem_comp/L/GOL/GOL.cif
3aok_final.cif title:
Crystal structure of sweet-tasting protein thaumatin II [more info...]
Chain information for 3aok_final.cif #1
---
Chain | Description | UniProt
A | THAUMATIN-2 | THM2_THADA 1-207
Non-standard residues in 3aok_final.cif #1
---
GOL — glycerol
TLA — L(+)-tartaric acid
> open C:/Users/user/Downloads/3wou.pdb
3wou.pdb title:
Crystal structure of the recombinant thaumatin II At 0.99 A [more info...]
Chain information for 3wou.pdb #2
---
Chain | Description | UniProt
A | thaumatin II | THM2_THADA 1-207
Non-standard residues in 3wou.pdb #2
---
GOL — glycerol (glycerin; propane-1,2,3-triol)
TLA — L(+)-tartaric acid
> ui windowfill toggle
[Repeated 2 time(s)]
> lighting full
> ui tool show "Selection Inspector"
> ui mousemode right select
> select #1/A:87
8 atoms, 7 bonds, 1 residue, 1 model selected
> select #1/A:88
5 atoms, 4 bonds, 1 residue, 1 model selected
> select #1/A:132
4 atoms, 3 bonds, 1 residue, 1 model selected
> select clear
> select #1/A:163
9 atoms, 8 bonds, 1 residue, 1 model selected
> color sel byelement
> show sel atoms
> select #2/A:103
10 atoms, 9 bonds, 1 residue, 1 model selected
> select #2/A:103
10 atoms, 9 bonds, 1 residue, 1 model selected
> show sel atoms
> select #1/A:101
8 atoms, 7 bonds, 1 residue, 1 model selected
> select #2/A:125
24 atoms, 23 bonds, 1 residue, 1 model selected
> select clear
> select #1/A:126
6 atoms, 5 bonds, 1 residue, 1 model selected
> show sel atoms
> show sel cartoons
[Repeated 2 time(s)]
> color sel cornflower blue
> color sel red
> color sel forest green
> color sel lime
> select #1/A:125
11 atoms, 10 bonds, 1 residue, 1 model selected
> show sel atoms
> select #1/A:124
7 atoms, 6 bonds, 1 residue, 1 model selected
> show sel atoms
> hide sel atoms
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> hide sel atoms
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> hide sel atoms
> color sel byelement
> color sel red
> select #2/A:114
20 atoms, 20 bonds, 1 residue, 1 model selected
> select #2/A:113
12 atoms, 11 bonds, 1 residue, 1 model selected
> show sel atoms
> select #1/A:125
11 atoms, 10 bonds, 1 residue, 1 model selected
> hide sel atoms
> select #2/A:113
12 atoms, 11 bonds, 1 residue, 1 model selected
> select #2/A:112
17 atoms, 16 bonds, 1 residue, 1 model selected
> select #2/A:113
12 atoms, 11 bonds, 1 residue, 1 model selected
> ui tool show Rotamers
[Repeated 1 time(s)]
> select #2/A:113
12 atoms, 11 bonds, 1 residue, 1 model selected
> ui tool show Rotamers
> swapaa interactive sel TYR rotLib Dunbrack
3wou.pdb #2/A ASP 113: phi -114.6, psi 136.7 trans
Changed 180 bond radii
> swapaa #!2/A:113 TYR criteria 1 rotLib Dunbrack
Using Dunbrack library
3wou.pdb #!2/A ASP 113: phi -114.6, psi 136.7 trans
Applying TYR rotamer (chi angles: -66.4 89.0) to 3wou.pdb #!2/A TYR 113
> swapaa interactive sel TRP rotLib Dunbrack
3wou.pdb #2/A TYR 113: phi -114.6, psi 136.7 trans
Changed 468 bond radii
> swapaa #!2/A:113 TRP criteria 1 rotLib Dunbrack
Using Dunbrack library
3wou.pdb #!2/A TYR 113: phi -114.6, psi 136.7 trans
Applying TRP rotamer (chi angles: -67.6 89.6) to 3wou.pdb #!2/A TRP 113
> swapaa interactive sel TRP rotLib Dunbrack
3wou.pdb #2/A TRP 113: phi -114.6, psi 136.7 trans
Changed 468 bond radii
> swapaa #!2/A:113 TRP criteria 1 rotLib Dunbrack retain false
Using Dunbrack library
3wou.pdb #!2/A TRP 113: phi -114.6, psi 136.7 trans
Applying TRP rotamer (chi angles: -67.6 89.6) to 3wou.pdb #!2/A TRP 113
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> show sel atoms
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> show sel atoms
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> show sel atoms
> select #1/A:125
11 atoms, 10 bonds, 1 residue, 1 model selected
> show sel atoms
> select #1/A:125
11 atoms, 10 bonds, 1 residue, 1 model selected
> select #2/A:113
16 atoms, 17 bonds, 1 residue, 1 model selected
> select #2/A:113
16 atoms, 17 bonds, 1 residue, 1 model selected
> select #2/A:113
16 atoms, 17 bonds, 1 residue, 1 model selected
> select #2/A:113@CA
1 atom, 1 residue, 1 model selected
> select #1/A:113
8 atoms, 7 bonds, 1 residue, 1 model selected
> hide sel atoms
[Repeated 5 time(s)]
> select #2/A:113@CB
1 atom, 1 residue, 1 model selected
> hide sel atoms
[Repeated 1 time(s)]
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> hide sel atoms
[Repeated 1 time(s)]
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> select #1/A:126
6 atoms, 5 bonds, 1 residue, 1 model selected
> hide sel cartoons
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> hide sel atoms
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> hide sel atoms
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> hide sel cartoons
> show sel cartoons
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> hide sel atoms
> select #1/A:126@CA
1 atom, 1 residue, 1 model selected
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> select #2/A:126
10 atoms, 9 bonds, 1 residue, 1 model selected
> hide sel atoms
[Repeated 1 time(s)]
> select #2/A:125
24 atoms, 23 bonds, 1 residue, 1 model selected
> hide sel atoms
[Repeated 1 time(s)]
> select #1/A:176
8 atoms, 7 bonds, 1 residue, 1 model selected
> select #1/A:176
8 atoms, 7 bonds, 1 residue, 1 model selected
> show sel atoms
> select #1/A:176
8 atoms, 7 bonds, 1 residue, 1 model selected
> select #1/A:176
8 atoms, 7 bonds, 1 residue, 1 model selected
> select #1/A:176
8 atoms, 7 bonds, 1 residue, 1 model selected
> ui tool show Rotamers
> swapaa interactive sel GLU rotLib Dunbrack
3aok_final.cif #1/A LEU 176: phi -72.0, psi -35.6 trans
Changed 324 bond radii
> swapaa #!1/A:176 GLU criteria 1 rotLib Dunbrack
Using Dunbrack library
3aok_final.cif #!1/A LEU 176: phi -72.0, psi -35.6 trans
Applying GLU rotamer (chi angles: -68.9 177.5 -9.2) to 3aok_final.cif #!1/A
GLU 176
> swapaa interactive sel GLU rotLib Dunbrack
3aok_final.cif #1/A GLU 176: phi -72.0, psi -35.6 trans
Changed 324 bond radii
> swapaa #!1/A:176 GLU criteria 1 rotLib Dunbrack retain false
Using Dunbrack library
3aok_final.cif #!1/A GLU 176: phi -72.0, psi -35.6 trans
Applying GLU rotamer (chi angles: -68.9 177.5 -9.2) to 3aok_final.cif #!1/A
GLU 176
> select #1/A:176
9 atoms, 8 bonds, 1 residue, 1 model selected
> select #1/A:173@CG
1 atom, 1 residue, 1 model selected
> hide sel atoms
> select #1/A:176
9 atoms, 8 bonds, 1 residue, 1 model selected
> hide sel atoms
[Repeated 1 time(s)]
> show sel atoms
> select #1/A:180
5 atoms, 4 bonds, 1 residue, 1 model selected
Drag select of 3 residues
> select #1/A:63
11 atoms, 10 bonds, 1 residue, 1 model selected
> select clear
> select #1/A:64
4 atoms, 3 bonds, 1 residue, 1 model selected
> select clear
> select #2/A:204
10 atoms, 9 bonds, 1 residue, 1 model selected
> select #1/A:132
4 atoms, 3 bonds, 1 residue, 1 model selected
> select #2/A:201
16 atoms, 15 bonds, 1 residue, 1 model selected
> select clear
> style sphere
Changed 5379 atom styles
> style sphere
Changed 5379 atom styles
> style stick
Changed 5379 atom styles
> style ball
Changed 5379 atom styles
> style ball
Changed 5379 atom styles
> style sphere
Changed 5379 atom styles
> style stick
Changed 5379 atom styles
> style sphere
Changed 5379 atom styles
> style ball
Changed 5379 atom styles
> style sphere
Changed 5379 atom styles
> select #2/A:169@CE1
1 atom, 1 residue, 1 model selected
> select #1/A:163@CE
1 atom, 1 residue, 1 model selected
> select #2/A:154@CG2
1 atom, 1 residue, 1 model selected
> style sel stick
Changed 1 atom style
> style sel stick
Changed 1 atom style
> style sel stick
Changed 1 atom style
> select #2/A:113@CH2
1 atom, 1 residue, 1 model selected
> style sel stick
Changed 1 atom style
> style sel stick
Changed 1 atom style
> style sel stick
Changed 1 atom style
> style sel stick
Changed 1 atom style
> style sel stick
Changed 1 atom style
> select clear
> style stick
Changed 5379 atom styles
> style sphere
Changed 5379 atom styles
> style stick
Changed 5379 atom styles
> select #2/A:113
16 atoms, 17 bonds, 1 residue, 1 model selected
> style sel sphere
Changed 16 atom styles
> style sel sphere
Changed 16 atom styles
> style sel ball
Changed 16 atom styles
> style sel stick
Changed 16 atom styles
> select clear
[Repeated 1 time(s)]
> style sphere
Changed 5379 atom styles
> select #2/A:113@CH2
1 atom, 1 residue, 1 model selected
> select clear
> style stick
Changed 5379 atom styles
> select #2/A:113@NE1
1 atom, 1 residue, 1 model selected
> select #1/A:115
6 atoms, 5 bonds, 1 residue, 1 model selected
> select clear
> lighting simple
[Repeated 1 time(s)]
> lighting soft
> lighting simple
> lighting soft
> lighting simple
> lighting soft
> lighting full
> lighting simple
> lighting flat
> lighting shadows true intensity 0.5
> lighting flat
[Repeated 4 time(s)]
> select clear
> lighting flat
> lighting full
> lighting flat
[Repeated 2 time(s)]
> lighting full
> graphics silhouettes false
> graphics silhouettes true
> lighting simple
[Repeated 5 time(s)]
> select clear
[Repeated 1 time(s)]
> lighting simple
[Repeated 1 time(s)]
> lighting soft
> lighting simple
> graphics silhouettes false
> graphics silhouettes true
> graphics silhouettes false
> lighting shadows true
> lighting shadows false
> lighting shadows true
> lighting shadows false
> lighting shadows true
> lighting flat
[Repeated 1 time(s)]
> lighting simple
> graphics silhouettes false
> graphics silhouettes true
> graphics silhouettes false
> lighting shadows true
> lighting simple
> graphics silhouettes true
> graphics silhouettes false
> lighting shadows true
> nucleotides atoms
> style nucleic stick
Changed 0 atom styles
> nucleotides atoms
> style nucleic stick
Changed 0 atom styles
> nucleotides fill
> style nucleic stick
Changed 0 atom styles
> nucleotides slab
> style nucleic stick
Changed 0 atom styles
> nucleotides tube/slab shape box
> color bynucleotide
> select clear
> hbonds reveal true
5411 hydrogen bonds found
> hbonds reveal true
5411 hydrogen bonds found
> hbonds reveal true
5411 hydrogen bonds found
Drag select of 2 residues, 4 atoms, 19 pseudobonds
Drag select of 29 atoms, 10 residues, 14 bonds, 76 pseudobonds
Drag select of 21 atoms, 4 residues, 8 bonds, 57 pseudobonds
> select clear
> ui tool show Rotamers
> hbonds reveal true
5411 hydrogen bonds found
> hbonds reveal true
5411 hydrogen bonds found
> ~hbonds
Drag select of 5 residues
> rainbow sel
[Repeated 1 time(s)]
> select clear
> rainbow
[Repeated 3 time(s)]
> color bypolymer
> color bychain
> color byhetero
[Repeated 1 time(s)]
> coulombic
Using Amber 20 recommended default charges and atom types for standard
residues
[Repeated 1 time(s)]Coulombic values for 3aok_final.cif_A SES surface #1.1:
minimum, -12.68, mean 0.21, maximum 13.47
Coulombic values for 3wou.pdb_A SES surface #2.1: minimum, -12.00, mean 1.99,
maximum 15.92
To also show corresponding color key, enter the above coulombic command and
add key true
> color bychain
[Repeated 1 time(s)]
> color bypolymer
> color bychain
> color byhetero
[Repeated 1 time(s)]
> select clear
[Repeated 2 time(s)]
> select #2/A:152@O
1 atom, 1 residue, 1 model selected
> select clear
[Repeated 1 time(s)]
Invalid texture upload for 0x18bc8f41360 layer=0 mip=0
> select #2/A
3475 atoms, 3076 bonds, 652 residues, 1 model selected
An error occurred in drawing the scene. Redrawing graphics is now stopped to
avoid a continuous stream of error messages. To restart graphics use the
command "graphics restart" after changing the settings that caused the error.
Unable to allocate 1.53 MiB for an array with shape (200184,) and data type
int64
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\updateloop.py", line 73, in draw_new_frame
view.draw(check_for_changes = False)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\view.py", line 177, in draw
self._draw_scene(camera, drawings)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\view.py", line 215, in _draw_scene
shadow, multishadow = self._compute_shadowmaps(opaque_drawings,
transparent_drawings, camera)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\view.py", line 609, in _compute_shadowmaps
shadow_enabled = r.shadow.use_shadow_map(camera, shadow_drawings)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\opengl.py", line 1438, in use_shadow_map
draw_depth(r, sdrawings, opaque_only = not
r.material.transparent_cast_shadows)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\drawing.py", line 1567, in draw_depth
draw_opaque(r, drawings)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\drawing.py", line 1542, in draw_opaque
_draw_multiple(drawings, renderer, Drawing.OPAQUE_DRAW_PASS)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\drawing.py", line 1555, in _draw_multiple
d.draw(renderer, draw_pass)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\drawing.py", line 768, in draw
self.draw_self(renderer, draw_pass)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\drawing.py", line 775, in draw_self
self._draw_geometry(renderer, opaque_only = any_transp)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\drawing.py", line 799, in _draw_geometry
self._update_buffers()
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\drawing.py", line 925, in _update_buffers
dss.update_element_buffer(ta, style, tmsel, em)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\drawing.py", line 1774, in update_element_buffer
e = self.masked_elements(triangles, style, triangle_mask, edge_mask)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\graphics\drawing.py", line 1802, in masked_elements
ta = ta[tmask, :]
numpy.core._exceptions._ArrayMemoryError: Unable to allocate 1.53 MiB for an
array with shape (200184,) and data type int64
Invalid texture upload for 0x18bc8f41360 layer=0 mip=0
[Repeated 1 time(s)]
OpenGL version: 3.3.0 Core Profile Context 22.20.44.24.221223
OpenGL renderer: AMD Radeon(TM) Graphics
OpenGL vendor: ATI Technologies Inc.
Python: 3.9.11
Locale: tr_TR.cp1254
Qt version: PyQt6 6.4.2, Qt 6.4.2
Qt runtime version: 6.4.3
Qt platform: windows
Manufacturer: LENOVO
Model: 82HU
OS: Microsoft Windows 11 Home Single Language (Build 22621)
Memory: 3,588,489,216
MaxProcessMemory: 137,438,953,344
CPU: 8 AMD Ryzen 3 5300U with Radeon Graphics
OSLanguage: tr-TR
Installed Packages:
alabaster: 0.7.13
appdirs: 1.4.4
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: 2023.5.7
cftime: 1.6.2
charset-normalizer: 3.1.0
ChimeraX-AddCharge: 1.5.9.1
ChimeraX-AddH: 2.2.5
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: 1.6.1
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
comtypes: 1.1.14
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: 2022.9.26
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: 23.1
ParmEd: 3.4.3
parso: 0.8.3
pep517: 0.13.0
pickleshare: 0.7.5
Pillow: 9.3.0
pip: 23.0
pkginfo: 1.9.6
platformdirs: 3.5.0
prompt-toolkit: 3.0.38
psutil: 5.9.4
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
pywin32: 305
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
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
WMI: 1.5.1
zipp: 3.15.0
Change History (3)
comment:1 by , 2 years ago
| Component: | Unassigned → Input/Output |
|---|---|
| Owner: | set to |
| Platform: | → all |
| Project: | → ChimeraX |
| Status: | new → assigned |
| Summary: | ChimeraX bug report submission → MemoryError opening mmCIF |
comment:2 by , 2 years ago
| Status: | assigned → feedback |
|---|
We believe this is fixed in the currently daily build. Please install it and confirm. Thanks.
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Reported by Muhammed Dağhan Okur