Opened 8 months ago
Closed 8 months ago
#17153 closed defect (fixed)
Web services down
| Reported by: | Owned by: | Zach Pearson | |
|---|---|---|---|
| Priority: | major | Milestone: | |
| Component: | Web Services | Version: | |
| Keywords: | Cc: | Eric Pettersen, julio.bonilla@… | |
| Blocked By: | Blocking: | ||
| Notify when closed: | Platform: | all | |
| Project: | ChimeraX |
Description
The following bug report has been submitted:
Platform: Windows-10-10.0.22631
ChimeraX Version: 1.7.1 (2024-01-23 01:58:08 UTC)
Description
Anytime I try: sequence align [#model_1/antigen_chain1, #model_2/antigen_chain_2] program clustalOmega
I get a "cannot create alignment of zero sequences" error, even on sequences I tried out earlier this week without any issue previously.
Log:
Startup Messages
---
note | available bundle cache has not been initialized yet
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
> C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py
Traceback (most recent call last):
File
"C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py",
line 2, in <module>
import pandas as pd
ModuleNotFoundError: No module named 'pandas'
Error opening python file
C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py
> pip install pandas
> pip install pyyaml
> open
> C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py
executed chimeraX_find_EP_and_surface.py
> find_epitopes_and_surfaces
> C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_Ag_test.yaml
PDB Dict: {'pdb': {'7UST': {'A': {'id': 'antigen1', 'include': True}, 'B':
{'id': 'ab_light', 'include': True}}, '6OHG': {'A': {'id': 'antigen2',
'include': True}, 'B': {'id': 'ab_light', 'include': True}, 'C': {'id':
'ab_heavy', 'include': True}}, '7UC8': {'A': {'id': 'antigen3', 'include':
True}, 'H': {'id': 'ab_heavy', 'include': True}}, '7USS': {'A': {'id':
'antigen4', 'include': True}}, '7USR': {'A': {'id': 'antigen5', 'include':
True}}, '7UVH': {'A': {'id': 'ab_heavy', 'include': True}, 'B': {'id':
'ab_light', 'include': True}, 'C': {'id': 'antigen6', 'include': True}}},
'destination': {'output_dir': 'C:/Users/grzesiak1/Downloads/chimerax_outputs',
'output_yaml_name': 'output.yaml'}}
> open 7UST fromDatabase rcsb_bio format mmcif maxAssemblies 1
7UST bioassembly 1 title:
Plasmodium falciparum protein Pfs230 D1 in complex with nanobody F5 [more
info...]
Chain information for 7UST bioassembly 1 #1
---
Chain | Description
A | Gametocyte surface protein P230
B | Nanobody F5
Non-standard residues in 7UST bioassembly 1 #1
---
SO4 — sulfate ion
Opened 1 biological assemblies for 7UST
Opened PDB: 7UST, Chain: A, Antigen ID: antigen1
> open 6OHG fromDatabase rcsb_bio format mmcif maxAssemblies 1
6OHG bioassembly 1 title:
Structure of Plasmodium falciparum vaccine candidate Pfs230D1M in complex with
the Fab of a transmission blocking antibody [more info...]
Chain information for 6OHG bioassembly 1 #2
---
Chain | Description
A | Gametocyte surface protein P230
B | 4F12 Light Chain
C | 4F12 Heavy chain
Non-standard residues in 6OHG bioassembly 1 #2
---
ACY — acetic acid
EDO — 1,2-ethanediol (ethylene glycol)
GOL — glycerol (glycerin; propane-1,2,3-triol)
MOH — methanol
PDO — 1,3-propandiol
Opened 1 biological assemblies for 6OHG
Opened PDB: 6OHG, Chain: A, Antigen ID: antigen2
> open 7UC8 fromDatabase rcsb_bio format mmcif maxAssemblies 1
7UC8 bioassembly 1 title:
Pfs230 D1 domain in complex with 230AS-73 [more info...]
Chain information for 7UC8 bioassembly 1 #3
---
Chain | Description
A | Gametocyte surface protein P230
H | 230AS-73
Opened 1 biological assemblies for 7UC8
Opened PDB: 7UC8, Chain: A, Antigen ID: antigen3
> open 7USS fromDatabase rcsb_bio format mmcif maxAssemblies 1
7USS bioassembly 1 title:
Plasmodium falciparum protein Pfs230 Pro-D1D2 - Structure of the first two
6-cysteine domains with N-terminal extension [more info...]
Chain information for 7USS bioassembly 1 #4
---
Chain | Description
A | Gametocyte surface protein P230
Non-standard residues in 7USS bioassembly 1 #4
---
FUC — alpha-L-fucopyranose (alpha-L-fucose; 6-deoxy-alpha-L-galactopyranose;
L-fucose; fucose)
K — potassium ion
NAG — 2-acetamido-2-deoxy-beta-D-glucopyranose (N-acetyl-beta-D-glucosamine;
2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE)
Opened 1 biological assemblies for 7USS
Opened PDB: 7USS, Chain: A, Antigen ID: antigen4
> open 7USR fromDatabase rcsb_bio format mmcif maxAssemblies 1
7USR bioassembly 1 title:
Plasmodium falciparum protein Pfs230 D1D2 - Structure of the first two
6-cysteine domains [more info...]
Chain information for 7USR bioassembly 1 #5
---
Chain | Description
A | Gametocyte surface protein P230
Non-standard residues in 7USR bioassembly 1 #5
---
FUC — alpha-L-fucopyranose (alpha-L-fucose; 6-deoxy-alpha-L-galactopyranose;
L-fucose; fucose)
NAG — 2-acetamido-2-deoxy-beta-D-glucopyranose (N-acetyl-beta-D-glucosamine;
2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE)
Opened 1 biological assemblies for 7USR
Opened PDB: 7USR, Chain: A, Antigen ID: antigen5
> open 7UVH fromDatabase rcsb_bio format mmcif maxAssemblies 1
7UVH bioassembly 1 title:
Pfs230 domain 1 bound by RUPA-32 Fab [more info...]
Chain information for 7UVH bioassembly 1 #6
---
Chain | Description
A | RUPA-32 Fab Heavy Chain
B | RUPA-32 Fab Light Chain
C | Gametocyte surface protein P230
Non-standard residues in 7UVH bioassembly 1 #6
---
CL — chloride ion
EDO — 1,2-ethanediol (ethylene glycol)
NH4 — ammonium ion
TRS — 2-amino-2-hydroxymethyl-propane-1,3-diol (tris buffer)
Opened 1 biological assemblies for 7UVH
Opened PDB: 7UVH, Chain: C, Antigen ID: antigen6
{'7UST': '#1/A', '6OHG': '#2/A', '7UC8': '#3/A', '7USS': '#4/A', '7USR':
'#5/A', '7UVH': '#6/C'}
{'7UST': '#1/B', '6OHG': '#2/B,C', '7UC8': '#3/H', '7USS': [], '7USR': [],
'7UVH': '#6/A,B'}
Running sequence alignment with command: sequence align
#1/A,#2/A,#3/A,#4/A,#5/A,#6/C program clustalOmega
> sequence align #1/A,#2/A,#3/A,#4/A,#5/A,#6/C program clustalOmega
Alignment identifier is 1
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\core\commands\cli.py", line 2908, in run
result = ci.function(session, **kw_args)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File
"C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py",
line 349, in main
align_antigens(session, antigen_chain_references)
File
"C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py",
line 85, in align_antigens
run(session, alignment_command)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\core\commands\run.py", line 49, 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 2908, in run
result = ci.function(session, **kw_args)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\cmd.py", line 372, in seqalign_align
return session.alignments.new_alignment(realigned, None, name=title)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\manager.py", line 253, in new_alignment
alignment = Alignment(self.session, seqs, identify_as, attrs, markups,
auto_destroy,
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
ValueError: Cannot create alignment of zero sequences
ValueError: Cannot create alignment of zero sequences
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
See log for complete Python traceback.
Exception in thread Thread-30 (_run_function):
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 1038, in
_bootstrap_inner
self.run()
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 975, in run
self._target(*self._args, **self._kwargs)
File "C:\Program Files\ChimeraX\bin\Lib\site-packages\chimerax\core\tasks.py",
line 285, in _run_function
func(*args, **kw)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\webservices\cxservices_job.py", line 132, in run
reason = json.loads(e.body)['description']
^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\\__init__.py", line 346, in loads
return _default_decoder.decode(s)
^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 337, in decode
obj, end = self.raw_decode(s, idx=_w(s, 0).end())
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 355, in
raw_decode
raise JSONDecodeError("Expecting value", s, err.value) from None
json.decoder.JSONDecodeError: Expecting value: line 1 column 1 (char 0)
> ui tool show "Show Sequence Viewer"
> sequence chain #1/A
Alignment identifier is 1/A
> sequence align #1/A,#2/A program clustalOmega
Alignment identifier is 1
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\core\commands\cli.py", line 2908, in run
result = ci.function(session, **kw_args)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\cmd.py", line 372, in seqalign_align
return session.alignments.new_alignment(realigned, None, name=title)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\manager.py", line 253, in new_alignment
alignment = Alignment(self.session, seqs, identify_as, attrs, markups,
auto_destroy,
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
ValueError: Cannot create alignment of zero sequences
ValueError: Cannot create alignment of zero sequences
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
See log for complete Python traceback.
Exception in thread Thread-49 (_run_function):
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 1038, in
_bootstrap_inner
self.run()
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 975, in run
self._target(*self._args, **self._kwargs)
File "C:\Program Files\ChimeraX\bin\Lib\site-packages\chimerax\core\tasks.py",
line 285, in _run_function
func(*args, **kw)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\webservices\cxservices_job.py", line 132, in run
reason = json.loads(e.body)['description']
^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\\__init__.py", line 346, in loads
return _default_decoder.decode(s)
^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 337, in decode
obj, end = self.raw_decode(s, idx=_w(s, 0).end())
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 355, in
raw_decode
raise JSONDecodeError("Expecting value", s, err.value) from None
json.decoder.JSONDecodeError: Expecting value: line 1 column 1 (char 0)
> close session
> open
> C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py
FYI: command is replacing existing command: "find_epitopes_and_surfaces"
executed chimeraX_find_EP_and_surface.py
> sequence align #1/A,#2/A program clustalOmega
Missing or invalid "seqSource" argument: Expected alignment-id or sequences
> find_epitopes_and_surfaces
> C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_Ag_test.yaml
PDB Dict: {'pdb': {'7UST': {'A': {'id': 'antigen1', 'include': True}, 'B':
{'id': 'ab_light', 'include': True}}, '6OHG': {'A': {'id': 'antigen2',
'include': True}, 'B': {'id': 'ab_light', 'include': True}, 'C': {'id':
'ab_heavy', 'include': True}}, '7UC8': {'A': {'id': 'antigen3', 'include':
True}, 'H': {'id': 'ab_heavy', 'include': True}}, '7USS': {'A': {'id':
'antigen4', 'include': True}}, '7USR': {'A': {'id': 'antigen5', 'include':
True}}, '7UVH': {'A': {'id': 'ab_heavy', 'include': True}, 'B': {'id':
'ab_light', 'include': True}, 'C': {'id': 'antigen6', 'include': True}}},
'destination': {'output_dir': 'C:/Users/grzesiak1/Downloads/chimerax_outputs',
'output_yaml_name': 'output.yaml'}}
> open 7UST fromDatabase rcsb_bio format mmcif maxAssemblies 1
7UST bioassembly 1 title:
Plasmodium falciparum protein Pfs230 D1 in complex with nanobody F5 [more
info...]
Chain information for 7UST bioassembly 1 #1
---
Chain | Description
A | Gametocyte surface protein P230
B | Nanobody F5
Non-standard residues in 7UST bioassembly 1 #1
---
SO4 — sulfate ion
Opened 1 biological assemblies for 7UST
Opened PDB: 7UST, Chain: A, Antigen ID: antigen1
> open 6OHG fromDatabase rcsb_bio format mmcif maxAssemblies 1
6OHG bioassembly 1 title:
Structure of Plasmodium falciparum vaccine candidate Pfs230D1M in complex with
the Fab of a transmission blocking antibody [more info...]
Chain information for 6OHG bioassembly 1 #2
---
Chain | Description
A | Gametocyte surface protein P230
B | 4F12 Light Chain
C | 4F12 Heavy chain
Non-standard residues in 6OHG bioassembly 1 #2
---
ACY — acetic acid
EDO — 1,2-ethanediol (ethylene glycol)
GOL — glycerol (glycerin; propane-1,2,3-triol)
MOH — methanol
PDO — 1,3-propandiol
Opened 1 biological assemblies for 6OHG
Opened PDB: 6OHG, Chain: A, Antigen ID: antigen2
> open 7UC8 fromDatabase rcsb_bio format mmcif maxAssemblies 1
7UC8 bioassembly 1 title:
Pfs230 D1 domain in complex with 230AS-73 [more info...]
Chain information for 7UC8 bioassembly 1 #3
---
Chain | Description
A | Gametocyte surface protein P230
H | 230AS-73
Opened 1 biological assemblies for 7UC8
Opened PDB: 7UC8, Chain: A, Antigen ID: antigen3
> open 7USS fromDatabase rcsb_bio format mmcif maxAssemblies 1
7USS bioassembly 1 title:
Plasmodium falciparum protein Pfs230 Pro-D1D2 - Structure of the first two
6-cysteine domains with N-terminal extension [more info...]
Chain information for 7USS bioassembly 1 #4
---
Chain | Description
A | Gametocyte surface protein P230
Non-standard residues in 7USS bioassembly 1 #4
---
FUC — alpha-L-fucopyranose (alpha-L-fucose; 6-deoxy-alpha-L-galactopyranose;
L-fucose; fucose)
K — potassium ion
NAG — 2-acetamido-2-deoxy-beta-D-glucopyranose (N-acetyl-beta-D-glucosamine;
2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE)
Opened 1 biological assemblies for 7USS
Opened PDB: 7USS, Chain: A, Antigen ID: antigen4
> open 7USR fromDatabase rcsb_bio format mmcif maxAssemblies 1
7USR bioassembly 1 title:
Plasmodium falciparum protein Pfs230 D1D2 - Structure of the first two
6-cysteine domains [more info...]
Chain information for 7USR bioassembly 1 #5
---
Chain | Description
A | Gametocyte surface protein P230
Non-standard residues in 7USR bioassembly 1 #5
---
FUC — alpha-L-fucopyranose (alpha-L-fucose; 6-deoxy-alpha-L-galactopyranose;
L-fucose; fucose)
NAG — 2-acetamido-2-deoxy-beta-D-glucopyranose (N-acetyl-beta-D-glucosamine;
2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE)
Opened 1 biological assemblies for 7USR
Opened PDB: 7USR, Chain: A, Antigen ID: antigen5
> open 7UVH fromDatabase rcsb_bio format mmcif maxAssemblies 1
7UVH bioassembly 1 title:
Pfs230 domain 1 bound by RUPA-32 Fab [more info...]
Chain information for 7UVH bioassembly 1 #6
---
Chain | Description
A | RUPA-32 Fab Heavy Chain
B | RUPA-32 Fab Light Chain
C | Gametocyte surface protein P230
Non-standard residues in 7UVH bioassembly 1 #6
---
CL — chloride ion
EDO — 1,2-ethanediol (ethylene glycol)
NH4 — ammonium ion
TRS — 2-amino-2-hydroxymethyl-propane-1,3-diol (tris buffer)
Opened 1 biological assemblies for 7UVH
Opened PDB: 7UVH, Chain: C, Antigen ID: antigen6
Running sequence alignment with command: sequence align
#1/A,#2/A,#3/A,#4/A,#5/A,#6/C program clustalOmega
> sequence align #1/A,#2/A,#3/A,#4/A,#5/A,#6/C program clustalOmega
Alignment identifier is 1
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\core\commands\cli.py", line 2908, in run
result = ci.function(session, **kw_args)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File
"C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py",
line 349, in main
align_antigens(session, antigen_chain_references)
File
"C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py",
line 85, in align_antigens
run(session, alignment_command)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\core\commands\run.py", line 49, 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 2908, in run
result = ci.function(session, **kw_args)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\cmd.py", line 372, in seqalign_align
return session.alignments.new_alignment(realigned, None, name=title)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\manager.py", line 253, in new_alignment
alignment = Alignment(self.session, seqs, identify_as, attrs, markups,
auto_destroy,
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
ValueError: Cannot create alignment of zero sequences
ValueError: Cannot create alignment of zero sequences
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
See log for complete Python traceback.
Exception in thread Thread-76 (_run_function):
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 1038, in
_bootstrap_inner
self.run()
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 975, in run
self._target(*self._args, **self._kwargs)
File "C:\Program Files\ChimeraX\bin\Lib\site-packages\chimerax\core\tasks.py",
line 285, in _run_function
func(*args, **kw)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\webservices\cxservices_job.py", line 132, in run
reason = json.loads(e.body)['description']
^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\\__init__.py", line 346, in loads
return _default_decoder.decode(s)
^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 337, in decode
obj, end = self.raw_decode(s, idx=_w(s, 0).end())
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 355, in
raw_decode
raise JSONDecodeError("Expecting value", s, err.value) from None
json.decoder.JSONDecodeError: Expecting value: line 1 column 1 (char 0)
> close session
> open
> C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py
FYI: command is replacing existing command: "find_epitopes_and_surfaces"
executed chimeraX_find_EP_and_surface.py
> find_epitopes_and_surfaces
> C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_Ag_test.yaml
PDB Dict: {'pdb': {'7UST': {'A': {'id': 'antigen1', 'include': True}, 'B':
{'id': 'ab_light', 'include': True}}, '6OHG': {'A': {'id': 'antigen2',
'include': True}, 'B': {'id': 'ab_light', 'include': True}, 'C': {'id':
'ab_heavy', 'include': True}}, '7UC8': {'A': {'id': 'antigen3', 'include':
True}, 'H': {'id': 'ab_heavy', 'include': True}}, '7USS': {'A': {'id':
'antigen4', 'include': True}}, '7USR': {'A': {'id': 'antigen5', 'include':
True}}, '7UVH': {'A': {'id': 'ab_heavy', 'include': True}, 'B': {'id':
'ab_light', 'include': True}, 'C': {'id': 'antigen6', 'include': True}}},
'destination': {'output_dir': 'C:/Users/grzesiak1/Downloads/chimerax_outputs',
'output_yaml_name': 'output.yaml'}}
> open 7UST fromDatabase rcsb_bio format mmcif maxAssemblies 1
7UST bioassembly 1 title:
Plasmodium falciparum protein Pfs230 D1 in complex with nanobody F5 [more
info...]
Chain information for 7UST bioassembly 1 #1
---
Chain | Description
A | Gametocyte surface protein P230
B | Nanobody F5
Non-standard residues in 7UST bioassembly 1 #1
---
SO4 — sulfate ion
Opened 1 biological assemblies for 7UST
Opened PDB: 7UST, Chain: A, Antigen ID: antigen1
> open 6OHG fromDatabase rcsb_bio format mmcif maxAssemblies 1
6OHG bioassembly 1 title:
Structure of Plasmodium falciparum vaccine candidate Pfs230D1M in complex with
the Fab of a transmission blocking antibody [more info...]
Chain information for 6OHG bioassembly 1 #2
---
Chain | Description
A | Gametocyte surface protein P230
B | 4F12 Light Chain
C | 4F12 Heavy chain
Non-standard residues in 6OHG bioassembly 1 #2
---
ACY — acetic acid
EDO — 1,2-ethanediol (ethylene glycol)
GOL — glycerol (glycerin; propane-1,2,3-triol)
MOH — methanol
PDO — 1,3-propandiol
Opened 1 biological assemblies for 6OHG
Opened PDB: 6OHG, Chain: A, Antigen ID: antigen2
> open 7UC8 fromDatabase rcsb_bio format mmcif maxAssemblies 1
7UC8 bioassembly 1 title:
Pfs230 D1 domain in complex with 230AS-73 [more info...]
Chain information for 7UC8 bioassembly 1 #3
---
Chain | Description
A | Gametocyte surface protein P230
H | 230AS-73
Opened 1 biological assemblies for 7UC8
Opened PDB: 7UC8, Chain: A, Antigen ID: antigen3
> open 7USS fromDatabase rcsb_bio format mmcif maxAssemblies 1
7USS bioassembly 1 title:
Plasmodium falciparum protein Pfs230 Pro-D1D2 - Structure of the first two
6-cysteine domains with N-terminal extension [more info...]
Chain information for 7USS bioassembly 1 #4
---
Chain | Description
A | Gametocyte surface protein P230
Non-standard residues in 7USS bioassembly 1 #4
---
FUC — alpha-L-fucopyranose (alpha-L-fucose; 6-deoxy-alpha-L-galactopyranose;
L-fucose; fucose)
K — potassium ion
NAG — 2-acetamido-2-deoxy-beta-D-glucopyranose (N-acetyl-beta-D-glucosamine;
2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE)
Opened 1 biological assemblies for 7USS
Opened PDB: 7USS, Chain: A, Antigen ID: antigen4
> open 7USR fromDatabase rcsb_bio format mmcif maxAssemblies 1
7USR bioassembly 1 title:
Plasmodium falciparum protein Pfs230 D1D2 - Structure of the first two
6-cysteine domains [more info...]
Chain information for 7USR bioassembly 1 #5
---
Chain | Description
A | Gametocyte surface protein P230
Non-standard residues in 7USR bioassembly 1 #5
---
FUC — alpha-L-fucopyranose (alpha-L-fucose; 6-deoxy-alpha-L-galactopyranose;
L-fucose; fucose)
NAG — 2-acetamido-2-deoxy-beta-D-glucopyranose (N-acetyl-beta-D-glucosamine;
2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE)
Opened 1 biological assemblies for 7USR
Opened PDB: 7USR, Chain: A, Antigen ID: antigen5
> open 7UVH fromDatabase rcsb_bio format mmcif maxAssemblies 1
7UVH bioassembly 1 title:
Pfs230 domain 1 bound by RUPA-32 Fab [more info...]
Chain information for 7UVH bioassembly 1 #6
---
Chain | Description
A | RUPA-32 Fab Heavy Chain
B | RUPA-32 Fab Light Chain
C | Gametocyte surface protein P230
Non-standard residues in 7UVH bioassembly 1 #6
---
CL — chloride ion
EDO — 1,2-ethanediol (ethylene glycol)
NH4 — ammonium ion
TRS — 2-amino-2-hydroxymethyl-propane-1,3-diol (tris buffer)
Opened 1 biological assemblies for 7UVH
Opened PDB: 7UVH, Chain: C, Antigen ID: antigen6
Running sequence alignment with command: sequence align
#1/A,#2/A,#3/A,#4/A,#5/A,#6/C program clustalOmega
> sequence align #1/A,#2/A,#3/A,#4/A,#5/A,#6/C program clustalOmega
Alignment identifier is 1
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\core\commands\cli.py", line 2908, in run
result = ci.function(session, **kw_args)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File
"C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py",
line 349, in main
align_antigens(session, antigen_chain_references)
File
"C:/Users/grzesiak1/abag_seq_analysisandvis/abag_seq_analysisandvis/chimeraX/chimeraX_find_EP_and_surface.py",
line 85, in align_antigens
run(session, alignment_command)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\core\commands\run.py", line 49, 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 2908, in run
result = ci.function(session, **kw_args)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\cmd.py", line 372, in seqalign_align
return session.alignments.new_alignment(realigned, None, name=title)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\manager.py", line 253, in new_alignment
alignment = Alignment(self.session, seqs, identify_as, attrs, markups,
auto_destroy,
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
ValueError: Cannot create alignment of zero sequences
ValueError: Cannot create alignment of zero sequences
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
See log for complete Python traceback.
Exception in thread Thread-102 (_run_function):
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 1038, in
_bootstrap_inner
self.run()
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 975, in run
self._target(*self._args, **self._kwargs)
File "C:\Program Files\ChimeraX\bin\Lib\site-packages\chimerax\core\tasks.py",
line 285, in _run_function
func(*args, **kw)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\webservices\cxservices_job.py", line 132, in run
reason = json.loads(e.body)['description']
^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\\__init__.py", line 346, in loads
return _default_decoder.decode(s)
^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 337, in decode
obj, end = self.raw_decode(s, idx=_w(s, 0).end())
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 355, in
raw_decode
raise JSONDecodeError("Expecting value", s, err.value) from None
json.decoder.JSONDecodeError: Expecting value: line 1 column 1 (char 0)
> close session
> open 7UVH fromDatabase rcsb_bio format mmcif maxAssemblies 1
7UVH bioassembly 1 title:
Pfs230 domain 1 bound by RUPA-32 Fab [more info...]
Chain information for 7UVH bioassembly 1 #1
---
Chain | Description
A | RUPA-32 Fab Heavy Chain
B | RUPA-32 Fab Light Chain
C | Gametocyte surface protein P230
Non-standard residues in 7UVH bioassembly 1 #1
---
CL — chloride ion
EDO — 1,2-ethanediol (ethylene glycol)
NH4 — ammonium ion
TRS — 2-amino-2-hydroxymethyl-propane-1,3-diol (tris buffer)
Opened 1 biological assemblies for 7UVH
> open 7USR fromDatabase rcsb_bio format mmcif maxAssemblies 1
7USR bioassembly 1 title:
Plasmodium falciparum protein Pfs230 D1D2 - Structure of the first two
6-cysteine domains [more info...]
Chain information for 7USR bioassembly 1 #2
---
Chain | Description
A | Gametocyte surface protein P230
Non-standard residues in 7USR bioassembly 1 #2
---
FUC — alpha-L-fucopyranose (alpha-L-fucose; 6-deoxy-alpha-L-galactopyranose;
L-fucose; fucose)
NAG — 2-acetamido-2-deoxy-beta-D-glucopyranose (N-acetyl-beta-D-glucosamine;
2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose;
2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE)
Opened 1 biological assemblies for 7USR
> sequence align #1/C,#2/A program clustalOmega
Alignment identifier is 1
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\core\commands\cli.py", line 2908, in run
result = ci.function(session, **kw_args)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\cmd.py", line 372, in seqalign_align
return session.alignments.new_alignment(realigned, None, name=title)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\manager.py", line 253, in new_alignment
alignment = Alignment(self.session, seqs, identify_as, attrs, markups,
auto_destroy,
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
ValueError: Cannot create alignment of zero sequences
ValueError: Cannot create alignment of zero sequences
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
See log for complete Python traceback.
Exception in thread Thread-119 (_run_function):
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 1038, in
_bootstrap_inner
self.run()
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 975, in run
self._target(*self._args, **self._kwargs)
File "C:\Program Files\ChimeraX\bin\Lib\site-packages\chimerax\core\tasks.py",
line 285, in _run_function
func(*args, **kw)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\webservices\cxservices_job.py", line 132, in run
reason = json.loads(e.body)['description']
^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\\__init__.py", line 346, in loads
return _default_decoder.decode(s)
^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 337, in decode
obj, end = self.raw_decode(s, idx=_w(s, 0).end())
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 355, in
raw_decode
raise JSONDecodeError("Expecting value", s, err.value) from None
json.decoder.JSONDecodeError: Expecting value: line 1 column 1 (char 0)
> select add #1
4701 atoms, 4731 bonds, 673 residues, 1 model selected
> select add #2
7301 atoms, 7080 bonds, 1 pseudobond, 1262 residues, 3 models selected
> sequence align #1/C,#2/A program clustalOmega
Alignment identifier is 1
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\core\commands\cli.py", line 2908, in run
result = ci.function(session, **kw_args)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\cmd.py", line 372, in seqalign_align
return session.alignments.new_alignment(realigned, None, name=title)
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\manager.py", line 253, in new_alignment
alignment = Alignment(self.session, seqs, identify_as, attrs, markups,
auto_destroy,
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
ValueError: Cannot create alignment of zero sequences
ValueError: Cannot create alignment of zero sequences
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\seqalign\alignment.py", line 85, in __init__
raise ValueError("Cannot create alignment of zero sequences")
See log for complete Python traceback.
Exception in thread Thread-135 (_run_function):
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 1038, in
_bootstrap_inner
self.run()
File "C:\Program Files\ChimeraX\bin\Lib\threading.py", line 975, in run
self._target(*self._args, **self._kwargs)
File "C:\Program Files\ChimeraX\bin\Lib\site-packages\chimerax\core\tasks.py",
line 285, in _run_function
func(*args, **kw)
File "C:\Program Files\ChimeraX\bin\Lib\site-
packages\chimerax\webservices\cxservices_job.py", line 132, in run
reason = json.loads(e.body)['description']
^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\\__init__.py", line 346, in loads
return _default_decoder.decode(s)
^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 337, in decode
obj, end = self.raw_decode(s, idx=_w(s, 0).end())
^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File "C:\Program Files\ChimeraX\bin\Lib\json\decoder.py", line 355, in
raw_decode
raise JSONDecodeError("Expecting value", s, err.value) from None
json.decoder.JSONDecodeError: Expecting value: line 1 column 1 (char 0)
OpenGL version: 3.3.0 - Build 31.0.101.2121
OpenGL renderer: Intel(R) UHD Graphics
OpenGL vendor: Intel
Python: 3.11.2
Locale: en_US.cp1252
Qt version: PyQt6 6.3.1, Qt 6.3.1
Qt runtime version: 6.3.2
Qt platform: windows
Manufacturer: HP
Model: HP EliteBook 840 G7 Notebook PC
OS: Microsoft Windows 11 Enterprise (Build 22631)
Memory: 34,122,080,256
MaxProcessMemory: 137,438,953,344
CPU: 8 Intel(R) Core(TM) i7-10510U CPU @ 1.80GHz
OSLanguage: en-US
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-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-ItemsInspection: 1.0.1
ChimeraX-IUPAC: 1.0
ChimeraX-Label: 1.1.8
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-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
comtypes: 1.1.14
contourpy: 1.2.0
cxservices: 1.2.2
cycler: 0.12.1
Cython: 0.29.33
debugpy: 1.8.0
decorator: 5.1.1
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
pandas: 2.2.3
ParmEd: 3.4.3
parso: 0.8.3
pep517: 0.13.0
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
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
pywin32: 305
PyYAML: 6.0.2
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
WMI: 1.5.1
Change History (3)
comment:1 by , 8 months ago
| Cc: | added |
|---|---|
| Component: | Unassigned → Web Services |
| Owner: | set to |
| Platform: | → all |
| Priority: | normal → major |
| Project: | → ChimeraX |
| Status: | new → assigned |
| Summary: | ChimeraX bug report submission → Web services down |
comment:2 by , 8 months ago
| Cc: | added |
|---|
comment:3 by , 8 months ago
| Resolution: | → fixed |
|---|---|
| Status: | assigned → closed |
They should be back up now, sorry for the inconvenience!
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'rq info' reports zero workers.
Reported by Emilia Grzesiak