Opened 7 years ago
Closed 7 years ago
#1356 closed defect (fixed)
Write PDB: 'polymeric_res_names' arg is not a sequence
| Reported by: | Owned by: | Eric Pettersen | |
|---|---|---|---|
| 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: Darwin-17.3.0-x86_64-i386-64bit ChimeraX Version: 0.8 (2018-10-06) Description I tried to save pdb file Log: Startup Messages --- note | available bundle cache has not been initialized yet UCSF ChimeraX version: 0.8 (2018-10-06) How to cite UCSF ChimeraX open /Users/doonam/Dropbox/ScottB_Coot_session/MIA.pdb ↵ Summary of feedback from opening /Users/doonam/Dropbox/ScottB_Coot_session/MIA.pdb --- warnings | Duplicate atom serial number found: 99999 Duplicate atom serial number found: 99999 Duplicate atom serial number found: 99999 Duplicate atom serial number found: 99999 Duplicate atom serial number found: 99999 23 messages similar to the above omitted addh hbond false ↵ Chain-initial residues that are actual N termini: Chain-initial residues that are not actual N termini: Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: Unknown hybridization for atom (P) of residue type MIAA 24 hydrogens added save h_.pdb ↵ Traceback (most recent call last): File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/cmd_line/tool.py", line 205, in execute cmd.run(cmd_text) File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/core/commands/cli.py", line 2562, in run result = ci.function(session, **kw_args) File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/core/commands/save.py", line 61, in save fmt.export(session, filename, fmt.nicknames[0], **kw) File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/core/io.py", line 198, in export result = self.export_func(session, path, **kw) File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/atomic/pdb/__init__.py", line 50, in save_file rel_model=rel_model, serial_numbering=serial_numbering) File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/atomic/pdb/pdb.py", line 108, in save_pdb (serial_numbering == "h36"), polymeric_res_names) TypeError: 'polymeric_res_names' arg is not a sequence TypeError: 'polymeric_res_names' arg is not a sequence File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/atomic/pdb/pdb.py", line 108, in save_pdb (serial_numbering == "h36"), polymeric_res_names) See log for complete Python traceback. save h.pdb ↵ Traceback (most recent call last): File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/cmd_line/tool.py", line 205, in execute cmd.run(cmd_text) File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/core/commands/cli.py", line 2562, in run result = ci.function(session, **kw_args) File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/core/commands/save.py", line 61, in save fmt.export(session, filename, fmt.nicknames[0], **kw) File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/core/io.py", line 198, in export result = self.export_func(session, path, **kw) File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/atomic/pdb/__init__.py", line 50, in save_file rel_model=rel_model, serial_numbering=serial_numbering) File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/atomic/pdb/pdb.py", line 108, in save_pdb (serial_numbering == "h36"), polymeric_res_names) TypeError: 'polymeric_res_names' arg is not a sequence TypeError: 'polymeric_res_names' arg is not a sequence File "/private/var/folders/6q/0gtmbyf129g94z9fkcnq9k_40000gn/T/AppTranslocation/88A39E66-4D3E-44B5-8ED4-BA4C31A1847A/d/ChimeraX.app/Contents/Library/Frameworks/Python.framework/Versions/3.6/lib/python3.6/site- packages/chimerax/atomic/pdb/pdb.py", line 108, in save_pdb (serial_numbering == "h36"), polymeric_res_names) See log for complete Python traceback. OpenGL version: 4.1 INTEL-10.30.12 OpenGL renderer: Intel(R) Iris(TM) Graphics 650 OpenGL vendor: Intel Inc.
Change History (3)
comment:1 by , 7 years ago
| Component: | Unassigned → Input/Output |
|---|---|
| Owner: | set to |
| Platform: | → all |
| Project: | → ChimeraX |
| Status: | new → accepted |
| Summary: | ChimeraX bug report submission → Write PDB: 'polymeric_res_names' arg is not a sequence |
comment:2 by , 7 years ago
comment:3 by , 7 years ago
| Resolution: | → fixed |
|---|---|
| Status: | accepted → closed |
Now fixed. In next daily build.
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Thanks for reporting this. It will be fixed in tonight's build. For just adding hydrogens and wrting a PDB file, you could use regular Chimera instead ChimeraX if you need to get it done today.
--Eric