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 |
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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