| Version 1 (modified by , 12 years ago) ( diff ) |
|---|
Trac Ticket Queries
Table of Contents
In addition to reports, Trac provides support for custom ticket queries, used to display lists of tickets meeting a specified set of criteria.
To configure and execute a custom query, switch to the View Tickets module from the navigation bar, and select the Custom Query link.
Filters
When you first go to the query page the default filter will display tickets relevant to you:
- If logged in then all open tickets it will display open tickets assigned to you.
- If not logged in but you have specified a name or email address in the preferences then it will display all open tickets where your email (or name if email not defined) is in the CC list.
- If not logged and no name/email defined in the preferences then all open issues are displayed.
Current filters can be removed by clicking the button to the left with the minus sign on the label. New filters are added from the pulldown lists at the bottom corners of the filters box ('And' conditions on the left, 'Or' conditions on the right). Filters with either a text box or a pulldown menu of options can be added multiple times to perform an or of the criteria.
You can use the fields just below the filters box to group the results based on a field, or display the full description for each ticket.
Once you've edited your filters click the Update button to refresh your results.
Navigating Tickets
Clicking on one of the query results will take you to that ticket. You can navigate through the results by clicking the Next Ticket or Previous Ticket links just below the main menu bar, or click the Back to Query link to return to the query page.
You can safely edit any of the tickets and continue to navigate through the results using the Next/Previous/Back to Query links after saving your results. When you return to the query any tickets which were edited will be displayed with italicized text. If one of the tickets was edited such that it no longer matches the query criteria the text will also be greyed. Lastly, if a new ticket matching the query criteria has been created, it will be shown in bold.
The query results can be refreshed and cleared of these status indicators by clicking the Update button again.
Saving Queries
Trac allows you to save the query as a named query accessible from the reports module. To save a query ensure that you have Updated the view and then click the Save query button displayed beneath the results. You can also save references to queries in Wiki content, as described below.
Note: one way to easily build queries like the ones below, you can build and test the queries in the Custom report module and when ready - click Save query. This will build the query string for you. All you need to do is remove the extra line breaks.
Note: you must have the REPORT_CREATE permission in order to save queries to the list of default reports. The Save query button will only appear if you are logged in as a user that has been granted this permission. If your account does not have permission to create reports, you can still use the methods below to save a query.
Using TracLinks
You may want to save some queries so that you can come back to them later. You can do this by making a link to the query from any Wiki page.
[query:status=new|assigned|reopened&version=1.0 Active tickets against 1.0]
Which is displayed as:
This uses a very simple query language to specify the criteria (see Query Language).
Alternatively, you can copy the query string of a query and paste that into the Wiki link, including the leading ? character:
[query:?status=new&status=assigned&status=reopened&group=owner Assigned tickets by owner]
Which is displayed as:
Using the [[TicketQuery]] Macro
The TicketQuery macro lets you display lists of tickets matching certain criteria anywhere you can use WikiFormatting.
Example:
[[TicketQuery(version=0.6|0.7&resolution=duplicate)]]
This is displayed as:
Just like the query: wiki links, the parameter of this macro expects a query string formatted according to the rules of the simple ticket query language. This also allows displaying the link and description of a single ticket:
[[TicketQuery(id=123)]]
This is displayed as:
- #123
- Crash in num_chains for 4v6w.cif
A more compact representation without the ticket summaries is also available:
[[TicketQuery(version=0.6|0.7&resolution=duplicate, compact)]]
This is displayed as:
Finally, if you wish to receive only the number of defects that match the query, use the count parameter.
[[TicketQuery(version=0.6|0.7&resolution=duplicate, count)]]
This is displayed as:
Customizing the table format
You can also customize the columns displayed in the table format (format=table) by using col=<field> - you can specify multiple fields and what order they are displayed by placing pipes (|) between the columns like below:
[[TicketQuery(max=3,status=closed,order=id,desc=1,format=table,col=resolution|summary|owner|reporter)]]
This is displayed as:
Results (1 - 3 of 13388)
Full rows
In table format you can also have full rows by using rows=<field> like below:
[[TicketQuery(max=3,status=closed,order=id,desc=1,format=table,col=resolution|summary|owner|reporter,rows=description)]]
This is displayed as:
Results (1 - 3 of 13388)
| Ticket | Resolution | Summary | Owner | Reporter |
|---|---|---|---|---|
| #19761 | duplicate | Color Actions: can only concatenate str (not "NoneType") to str | ||
| Description |
The following bug report has been submitted:
Platform: macOS-26.2-arm64-arm-64bit
ChimeraX Version: 1.9.dev202405090425 (2024-05-09 04:25:54 UTC)
Description
(Describe the actions that caused this problem to occur here)
Log:
UCSF ChimeraX version: 1.9.dev202405090425 (2024-05-09)
© 2016-2024 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
> open /Users/mojganasadi/Downloads/4GA8.pdb
4GA8.pdb title:
Human AKR1B10 mutant V301L complexed with nadp+ and sorbinil [more info...]
Chain information for 4GA8.pdb #1
---
Chain | Description | UniProt
A | ALDO-keto reductase family 1 member B10 | AK1BA_HUMAN 1-316
Non-standard residues in 4GA8.pdb #1
---
NAP — nadp nicotinamide-adenine-dinucleotide phosphate
(2'-monophosphoadenosine 5'-diphosphoribose)
SBI — sorbinil
170 atoms have alternate locations. Control/examine alternate locations with
Altloc Explorer [start tool...] or the altlocs command.
> select ::name="SBI"
17 atoms, 19 bonds, 1 residue, 1 model selected
> ui tool show "Model Loops"
Populating font family aliases took 53 ms. Replace uses of missing font family
"Times" with one that exists to avoid this cost.
> ui tool show "Show Sequence Viewer"
> sequence chain /A
Alignment identifier is 1/A
> select /A:220
14 atoms, 15 bonds, 1 residue, 1 model selected
> select /A:220
14 atoms, 15 bonds, 1 residue, 1 model selected
> select add /A:21
28 atoms, 30 bonds, 2 residues, 1 model selected
> hide #* target a
> show sel target ab
> select clear
> select ::name="ARG"
110 atoms, 100 bonds, 10 residues, 1 model selected
> select /A:218
11 atoms, 10 bonds, 1 residue, 1 model selected
> show sel target ab
> select ::name="ARG"
110 atoms, 100 bonds, 10 residues, 1 model selected
> select clear
> select add /A:297
11 atoms, 10 bonds, 1 residue, 1 model selected
> show sel target ab
> hide sel target a
> select clear
> select /A:21@CH2
1 atom, 1 residue, 1 model selected
> select add /A:220@CH2
2 atoms, 2 residues, 1 model selected
> ui tool show Distances
> distance /A:21@CH2 /A:220@CH2
Distance between /A TRP 21 CH2 and TRP 220 CH2: 3.601Å
> select /A:220@CZ3
1 atom, 1 residue, 1 model selected
> ui tool show "Build Structure"
> build modify /A:220@CZ3 C 3 geometry tetrahedral resName UNK
> select clear
> select /A:220@HZ3
1 atom, 1 residue, 1 model selected
> delete atoms sel
> delete bonds sel
> select /A:220@CZ3
1 atom, 1 residue, 1 model selected
> select /A:220@NE1
1 atom, 1 residue, 1 model selected
> select add /A:218@NE
2 atoms, 2 residues, 1 model selected
> distance /A:220@NE1 /A:218@NE
Distance between /A UNK 220 NE1 and ARG 218 NE: 3.818Å
> select clear
> select ::name="CYS"
24 atoms, 20 bonds, 4 residues, 1 model selected
> hide #* target a
> show sel target ab
> hide sel target a
> select clear
> select add /A:210
12 atoms, 12 bonds, 1 residue, 1 model selected
> select /A:211
6 atoms, 5 bonds, 1 residue, 1 model selected
> select add /A:212
13 atoms, 12 bonds, 2 residues, 1 model selected
> select add /A:213
21 atoms, 19 bonds, 3 residues, 1 model selected
> select add /A:214
25 atoms, 22 bonds, 4 residues, 1 model selected
> select add /A:215
31 atoms, 27 bonds, 5 residues, 1 model selected
> select add /A:216
38 atoms, 34 bonds, 6 residues, 1 model selected
> select add /A:217
46 atoms, 41 bonds, 7 residues, 1 model selected
> select add /A:219
53 atoms, 48 bonds, 8 residues, 1 model selected
> select add /A:218
64 atoms, 58 bonds, 9 residues, 1 model selected
> select add /A:220
78 atoms, 73 bonds, 10 residues, 1 model selected
> select add /A:221
83 atoms, 77 bonds, 11 residues, 1 model selected
> select add /A:222
92 atoms, 85 bonds, 12 residues, 1 model selected
> select add /A:223
99 atoms, 92 bonds, 13 residues, 1 model selected
> select add /A:224
108 atoms, 100 bonds, 14 residues, 1 model selected
> select add /A:225
116 atoms, 107 bonds, 15 residues, 1 model selected
> select add /A:226
123 atoms, 114 bonds, 16 residues, 1 model selected
> color sel magenta
> select clear
> color byhetero
> ui tool show "Color Actions"
Traceback (most recent call last):
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 64, in <lambda>
button.released.connect(lambda *, clr=spaced_name: self._color(clr))
^^^^^^^^^^^^^^^^
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 226, in _color
commands.append("color "
^^^^^^^^
TypeError: can only concatenate str (not "NoneType") to str
TypeError: can only concatenate str (not "NoneType") to str
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 226, in _color
commands.append("color "
^^^^^^^^
See log for complete Python traceback.
> set bgColor white
> select ::name="TYR"
133 atoms, 133 bonds, 11 residues, 1 model selected
> select /A:49
12 atoms, 12 bonds, 1 residue, 1 model selected
> show sel target ab
> select ::name="HIS"
90 atoms, 90 bonds, 9 residues, 1 model selected
> select /A:111
10 atoms, 10 bonds, 1 residue, 1 model selected
> show sel target ab
> select ::name="CYS"
24 atoms, 20 bonds, 4 residues, 1 model selected
> select /A:299
6 atoms, 5 bonds, 1 residue, 1 model selected
> show sel target ab
> select clear
> select /A:160
6 atoms, 5 bonds, 1 residue, 1 model selected
> select /A:111
10 atoms, 10 bonds, 1 residue, 1 model selected
> style sel sphere
Changed 10 atom styles
> style sel ball
Changed 10 atom styles
> select clear
[Repeated 2 time(s)]
> select /A:49
12 atoms, 12 bonds, 1 residue, 1 model selected
> style sel ball
Changed 12 atom styles
> select clear
> select /A:299
6 atoms, 5 bonds, 1 residue, 1 model selected
> style sel ball
Changed 6 atom styles
> select clear
> color blue
> show cartoons
> color purple
> ui tool show "Color Actions"
Traceback (most recent call last):
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 188, in <lambda>
button.released.connect(lambda *, clr=spaced_name: self._color(clr))
^^^^^^^^^^^^^^^^
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 226, in _color
commands.append("color "
^^^^^^^^
TypeError: can only concatenate str (not "NoneType") to str
TypeError: can only concatenate str (not "NoneType") to str
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 226, in _color
commands.append("color "
^^^^^^^^
See log for complete Python traceback.
> ui tool show "Color Actions"
Traceback (most recent call last):
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 188, in <lambda>
button.released.connect(lambda *, clr=spaced_name: self._color(clr))
^^^^^^^^^^^^^^^^
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 226, in _color
commands.append("color "
^^^^^^^^
TypeError: can only concatenate str (not "NoneType") to str
TypeError: can only concatenate str (not "NoneType") to str
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 226, in _color
commands.append("color "
^^^^^^^^
See log for complete Python traceback.
> ui tool show "Color Actions"
Traceback (most recent call last):
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 188, in <lambda>
button.released.connect(lambda *, clr=spaced_name: self._color(clr))
^^^^^^^^^^^^^^^^
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 226, in _color
commands.append("color "
^^^^^^^^
TypeError: can only concatenate str (not "NoneType") to str
TypeError: can only concatenate str (not "NoneType") to str
File
"/Applications/ChimeraX_Daily.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/color_actions/tool.py", line 226, in _color
commands.append("color "
^^^^^^^^
See log for complete Python traceback.
OpenGL version: 4.1 Metal - 90.5
OpenGL renderer: Apple M2
OpenGL vendor: Apple
Python: 3.11.4
Locale: en_US.UTF-8
Qt version: PyQt6 6.6.1, Qt 6.6.1
Qt runtime version: 6.6.3
Qt platform: cocoa
Hardware:
Hardware Overview:
Model Name: MacBook Air
Model Identifier: Mac14,2
Model Number: Z15Z0005ELL/A
Chip: Apple M2
Total Number of Cores: 8 (4 performance and 4 efficiency)
Memory: 16 GB
System Firmware Version: 13822.61.10
OS Loader Version: 13822.61.10
Software:
System Software Overview:
System Version: macOS 26.2 (25C56)
Kernel Version: Darwin 25.2.0
Time since boot: 7 days, 11 hours, 21 minutes
Graphics/Displays:
Apple M2:
Chipset Model: Apple M2
Type: GPU
Bus: Built-In
Total Number of Cores: 10
Vendor: Apple (0x106b)
Metal Support: Metal 4
Displays:
Color LCD:
Display Type: Built-in Liquid Retina Display
Resolution: 2560 x 1664 Retina
Main Display: Yes
Mirror: Off
Online: Yes
Automatically Adjust Brightness: Yes
Connection Type: Internal
Installed Packages:
alabaster: 0.7.16
appdirs: 1.4.4
appnope: 0.1.4
asttokens: 2.4.1
Babel: 2.15.0
beautifulsoup4: 4.12.3
blockdiag: 3.0.0
blosc2: 2.0.0
build: 1.2.1
certifi: 2023.11.17
cftime: 1.6.3
charset-normalizer: 3.3.2
ChimeraX-AddCharge: 1.5.17
ChimeraX-AddH: 2.2.6
ChimeraX-AlignmentAlgorithms: 2.0.2
ChimeraX-AlignmentHdrs: 3.5
ChimeraX-AlignmentMatrices: 2.1
ChimeraX-Alignments: 2.12.6
ChimeraX-AlphaFold: 1.0
ChimeraX-AltlocExplorer: 1.1.1
ChimeraX-AmberInfo: 1.0
ChimeraX-Arrays: 1.1
ChimeraX-Atomic: 1.57
ChimeraX-AtomicLibrary: 14.0.3
ChimeraX-AtomSearch: 2.0.1
ChimeraX-AxesPlanes: 2.4
ChimeraX-BasicActions: 1.1.2
ChimeraX-BILD: 1.0
ChimeraX-BlastProtein: 2.4.6
ChimeraX-BondRot: 2.0.4
ChimeraX-BugReporter: 1.0.1
ChimeraX-BuildStructure: 2.12.1
ChimeraX-Bumps: 1.0
ChimeraX-BundleBuilder: 1.2.3
ChimeraX-ButtonPanel: 1.0.1
ChimeraX-CageBuilder: 1.0.1
ChimeraX-CellPack: 1.0
ChimeraX-Centroids: 1.4
ChimeraX-ChangeChains: 1.1
ChimeraX-CheckWaters: 1.4
ChimeraX-ChemGroup: 2.0.1
ChimeraX-Clashes: 2.2.4
ChimeraX-ColorActions: 1.0.4
ChimeraX-ColorGlobe: 1.0
ChimeraX-ColorKey: 1.5.6
ChimeraX-CommandLine: 1.2.5
ChimeraX-ConnectStructure: 2.0.1
ChimeraX-Contacts: 1.0.1
ChimeraX-Core: 1.9.dev202405090425
ChimeraX-CoreFormats: 1.2
ChimeraX-coulombic: 1.4.3
ChimeraX-Crosslinks: 1.0
ChimeraX-Crystal: 1.0
ChimeraX-CrystalContacts: 1.0.1
ChimeraX-DataFormats: 1.2.3
ChimeraX-Dicom: 1.2
ChimeraX-DiffPlot: 1.0
ChimeraX-DistMonitor: 1.4.2
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: 1.1.9
ChimeraX-ListInfo: 1.2.2
ChimeraX-Log: 1.1.6
ChimeraX-LookingGlass: 1.1
ChimeraX-Maestro: 1.9.1
ChimeraX-Map: 1.2
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: 2.1.3
ChimeraX-MCopy: 1.0
ChimeraX-MDcrds: 2.7
ChimeraX-MedicalToolbar: 1.0.2
ChimeraX-Meeting: 1.0.1
ChimeraX-MLP: 1.1.1
ChimeraX-mmCIF: 2.14.1
ChimeraX-MMTF: 2.2
ChimeraX-Modeller: 1.5.15
ChimeraX-ModelPanel: 1.5
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-NMRSTAR: 1.0.2
ChimeraX-NRRD: 1.1
ChimeraX-Nucleotides: 2.0.3
ChimeraX-OpenCommand: 1.13.4
ChimeraX-PDB: 2.7.5
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: 1.1.1
ChimeraX-PubChem: 2.2
ChimeraX-ReadPbonds: 1.0.1
ChimeraX-Registration: 1.1.2
ChimeraX-RemoteControl: 1.0
ChimeraX-RenderByAttr: 1.4.1
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-Segmentations: 1.3.0
ChimeraX-SelInspector: 1.0
ChimeraX-SeqView: 2.11.2
ChimeraX-Shape: 1.0.1
ChimeraX-Shell: 1.0.1
ChimeraX-Shortcuts: 1.1.1
ChimeraX-ShowSequences: 1.0.3
ChimeraX-SideView: 1.0.1
ChimeraX-Smiles: 2.1.2
ChimeraX-SmoothLines: 1.0
ChimeraX-SpaceNavigator: 1.0
ChimeraX-StdCommands: 1.16.4
ChimeraX-STL: 1.0.1
ChimeraX-Storm: 1.0
ChimeraX-StructMeasure: 1.2.1
ChimeraX-Struts: 1.0.1
ChimeraX-Surface: 1.0.1
ChimeraX-SwapAA: 2.0.1
ChimeraX-SwapRes: 2.5
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: 1.39
ChimeraX-uniprot: 2.3
ChimeraX-UnitCell: 1.0.1
ChimeraX-ViewDockX: 1.4.1
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: 1.1.4
ChimeraX-Zone: 1.0.1
colorama: 0.4.6
comm: 0.2.2
contourpy: 1.2.1
cxservices: 1.2.2
cycler: 0.12.1
Cython: 3.0.10
debugpy: 1.8.1
decorator: 5.1.1
docutils: 0.20.1
executing: 2.0.1
filelock: 3.13.4
fonttools: 4.51.0
funcparserlib: 2.0.0a0
glfw: 2.7.0
grako: 3.16.5
h5py: 3.11.0
html2text: 2024.2.26
idna: 3.7
ihm: 1.0
imagecodecs: 2024.1.1
imagesize: 1.4.1
ipykernel: 6.29.2
ipython: 8.21.0
ipywidgets: 8.1.2
jedi: 0.19.1
jinja2: 3.1.4
jupyter-client: 8.6.0
jupyter-core: 5.7.2
jupyterlab-widgets: 3.0.10
kiwisolver: 1.4.5
line-profiler: 4.1.2
lxml: 5.2.1
lz4: 4.3.3
MarkupSafe: 2.1.5
matplotlib: 3.8.4
matplotlib-inline: 0.1.7
msgpack: 1.0.8
nest-asyncio: 1.6.0
netCDF4: 1.6.5
networkx: 3.3
nibabel: 5.2.0
nptyping: 2.5.0
numexpr: 2.10.0
numpy: 1.26.4
openvr: 1.26.701
packaging: 23.2
ParmEd: 4.2.2
parso: 0.8.4
pep517: 0.13.1
pexpect: 4.9.0
pillow: 10.3.0
pip: 24.0
pkginfo: 1.10.0
platformdirs: 4.2.1
prompt-toolkit: 3.0.43
psutil: 5.9.8
ptyprocess: 0.7.0
pure-eval: 0.2.2
py-cpuinfo: 9.0.0
pycollada: 0.8
pydicom: 2.4.4
pygments: 2.17.2
pynmrstar: 3.3.4
pynrrd: 1.0.0
PyOpenGL: 3.1.7
PyOpenGL-accelerate: 3.1.7
pyopenxr: 1.0.3401
pyparsing: 3.1.2
pyproject-hooks: 1.1.0
PyQt6-commercial: 6.6.1
PyQt6-Qt6: 6.6.3
PyQt6-sip: 13.6.0
PyQt6-WebEngine-commercial: 6.6.0
PyQt6-WebEngine-Qt6: 6.6.3
python-dateutil: 2.9.0.post0
pytz: 2024.1
pyzmq: 26.0.3
qtconsole: 5.5.1
QtPy: 2.4.1
RandomWords: 0.4.0
requests: 2.31.0
scipy: 1.13.0
setuptools: 69.5.1
setuptools-scm: 8.0.4
sfftk-rw: 0.8.1
six: 1.16.0
snowballstemmer: 2.2.0
sortedcontainers: 2.4.0
soupsieve: 2.5
sphinx: 7.2.6
sphinx-autodoc-typehints: 2.0.1
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: 0.6.3
tables: 3.8.0
tcia-utils: 1.5.1
tifffile: 2024.1.30
tinyarray: 1.2.4
tornado: 6.4
traitlets: 5.14.2
typing-extensions: 4.11.0
tzdata: 2024.1
urllib3: 2.2.1
wcwidth: 0.2.13
webcolors: 1.13
wheel: 0.43.0
wheel-filename: 1.4.1
widgetsnbextension: 4.0.10
|
|||
| #19760 | fixed | Mutations scores adjust colors: ValueError: '#faffff' is not a built-in color name | ||
| Description |
The following bug report has been submitted:
Platform: macOS-15.7.3-arm64-arm-64bit
ChimeraX Version: 1.11rc202511270036 (2025-11-27 00:36:15 UTC)
Description
When clicking on 'Adjust Colors' in mutation coloring history panel somtimes it ends up not opening up the coloring panel.
Log:
You can double click a model's Name or ID in the model panel to edit those
fields
UCSF ChimeraX version: 1.11rc202511270036 (2025-11-27)
© 2016-2025 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
> open /Users/willowcoyote-maestas/Downloads/8efq.cif format mmcif
8efq.cif title:
DAMGO-bound mu-opioid receptor-Gi complex [more info...]
Chain information for 8efq.cif #1
---
Chain | Description | UniProt
A | Guanine nucleotide-binding protein G(i) subunit alpha-1 | GNAI1_HUMAN 1-354
B | Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1 | GBB1_RAT 2-340
G | Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2 | GBG2_BOVIN 1-68
P | DAMGO |
R | Mu-type opioid receptor | OPRM_HUMAN 2-368
Non-standard residues in 8efq.cif #1
---
ETA — ethanolamine
> open "/Users/willowcoyote-maestas/Library/CloudStorage/Box-Box/WCM
> Lab/Willow/MOR_analysis/012026/composite_dms_scores_chimera_fits.csv"
Duplicated mutation "p.(N9K)" at line 143
> open "/Users/willowcoyote-maestas/Library/CloudStorage/Box-Box/WCM
> Lab/Willow/MOR_analysis/012026/composite_dms_scores_chimera_fits.csv"
Summary of feedback from opening /Users/willowcoyote-
maestas/Library/CloudStorage/Box-Box/WCM
Lab/Willow/MOR_analysis/012026/composite_dms_scores_chimera_fits.csv
---
note | Plotted 7560 mutations with Boltz2_Buprenorphine_affinity on x-axis and Boltz2_Butorphanol_affinity on y-axis
Opened deep mutational scan data for 7832 mutations of 399 residues with score
names Boltz2_Buprenorphine_affinity, Boltz2_Butorphanol_affinity,
Boltz2_C6guano_affinity, Boltz2_DAMGO_affinity, Boltz2_FSK_affinity,
Boltz2_Fentanyl_affinity, Boltz2_MCAM_affinity, Boltz2_MP_affinity,
Boltz2_Methadone_affinity, Boltz2_Morphine_affinity,
Boltz2_Nalbuphine_affinity, Boltz2_Naloxone_affinity,
Boltz2_Naltrexone_affinity, Boltz2_PZM21_affinity, Boltz2_SR17018_affinity,
Boltz2_TRV130_affinity, Boltz2_carfentanil_affinity, Buprenorphine_effect,
Butorphanol_effect, C6guano_effect, DAMGO_ec50, DAMGO_effect, DAMGO_emax,
DAMGO_emin, DAMGO_range, FSK_effect, Fentanyl_ec50, Fentanyl_effect,
Fentanyl_emax, Fentanyl_emin, Fentanyl_range, Fentanyl_slope, MCAM_effect,
MP_effect, Methadone_effect, Morphine_ec50, Morphine_effect, Morphine_emax,
Morphine_emin, Morphine_range, Morphine_slope, Nalbuphine_effect,
Naloxone_effect, Naltrexone_effect, PZM21_effect, SR17018_effect,
Surface_effect, TRV130_effect, carfentanil_effect, position.
Mutation set composite_dms_scores_chimera_fits has 1 associated chains #1/R.
Drag select of 3410 atoms, 2 pseudobonds
> hide sel atoms
Drag select of 298 atoms
> hide sel atoms
Drag select of 160 atoms
> hide sel atoms
Drag select of 3178 atoms, 38 bonds
> show sel cartoons
> hide sel atoms
Drag select of 432 residues
> hide sel cartoons
> show sel cartoons
Drag select of 396 residues
Drag select of 469 residues, 2 pseudobonds
Drag select of 311 residues
> select clear
Drag select of 419 residues
> hide sel cartoons
> select
> /R:83,149-150,153-154,179,235,238-239,242,246,257,294-295,297-299,302,308,323-324,327-328
190 atoms, 184 bonds, 23 residues, 1 model selected
> show sel atoms
> select
> /R:76-77,107,122-123,125-126,129,135,142,145-146,149-150,153-154,156,186,194,217,219,234,242-243,246,252,298-299,308,320-321,324-325,327-329,334
315 atoms, 306 bonds, 37 residues, 1 model selected
> show sel atoms
Drag select of 262 atoms, 300 residues
> hide sel atoms
> select
> /R:69,76-77,79-80,93,96,107,111,113,115-116,118-120,122-123,125-126,129-132,135-137,142,145-146,149-150,152-154,156,158,169,186,194,198,201-202,204,206,208,210,212-213,215,217-219,223-224,234-235,237,239-240,242-243,246-247,252,257-258,260,263,267,291,295-300,308,312,315-316,320-321,324-329,332,334-335,339,341,347
778 atoms, 754 bonds, 94 residues, 1 model selected
> select
> /R:69,76-77,80,107,115,118,122-123,125-126,129,131,135-136,142,145-146,149-150,153-154,156,186,194,198,208,217,219,234-235,240,242-243,246,252,291,297-299,308,316,320-321,324-329,332,334
426 atoms, 410 bonds, 52 residues, 1 model selected
> show sel atoms
> select clear
> select
> /R:76-77,107,122-123,125-126,129,135,142,145-146,149-150,153-154,156,194,219,234,242-243,246,252,298-299,308,320-321,324,327-329,334
297 atoms, 290 bonds, 34 residues, 1 model selected
Drag select of 314 atoms, 241 residues
> hide sel atoms
> select clear
> select
> /R:76,107,122-123,125-126,129,135,142,145-146,149-150,153,219,234,242-243,246,252,298-299,321,324,327-329,334
233 atoms, 223 bonds, 28 residues, 1 model selected
> show sel atoms
> select clear
Drag select of 154 atoms, 306 residues
> hide sel atoms
[Repeated 5 time(s)]
> show sel atoms
> hide sel atoms
Drag select of 149 atoms, 301 residues
> hide sel atoms
> select clear
> select
> /R:77,80,84,94,100,108-109,115-116,120,122-123,126,135,144-145,149,151-154,156-157,159,163-164,166-167,170-171,173-175,177-178,180-183,189,193,196,201,207,219-220,233-235,241-243,246-247,249-250,254-257,261-262,277,279-280,284,286-287,289,291,294-296,298-299,301-302,318,321,323-325,327-331,334-335,337-341,346-347
778 atoms, 752 bonds, 96 residues, 1 model selected
> mutationscores define
> Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean fromScoreName
> Fentanyl_emax combine mean ranges "Surface_effect >= -0.241 and
> Surface_effect <= 0.315 and Fentanyl_emax >= -0.278 and Fentanyl_emax <=
> 0.192"
Defined score Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean
having range -0.277 to 0.0504 for 97 residues using 276 mutations
Set attribute Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean for
96 residues of chain #1/R
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> 0.0504,white:-0.0661,#ff7f7f:-0.182,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> ui tool show "Render/Select by Attribute"
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #!1 target
> sabc palette -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red
7046 atoms, 894 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> select
> /R:77,80-81,84,90-91,93-94,98,100,104-106,108-109,115-116,119-120,122-123,144,149,151-157,159,163-164,166-167,169-172,174-175,177-178,180-183,187,189-190,192-193,196,201,219,234,237-238,240-243,246-247,249-251,253-258,260-262,273,277-281,284,286-287,289-291,295-296,298-299,301-302,321,323,327-328,330-332,334-339,346-347
868 atoms, 841 bonds, 109 residues, 1 model selected
> select
> /R:76-77,80-81,84,90-91,93-94,98-100,104-106,108-109,115-116,119-120,122-123,144,149,151-157,159,163-164,166-167,169-172,174-175,177-178,180-184,187,189-190,192-193,196-197,201,219,234,237-238,240-243,246-247,249-251,253-258,260-262,273,277-281,284-287,289-291,295-296,298-302,321,323,327-332,334-340,344,346-348
948 atoms, 925 bonds, 119 residues, 1 model selected
> select
> /R:76-77,80,84,90-91,93-94,98-100,105-106,108,115-116,119-120,122-123,144,149,151-157,159,163-164,166-167,169-172,174-175,177-178,180-184,187,189-190,192-193,196-197,201,219,234,237-238,240-243,246-247,249-251,253-258,260-262,273,277-278,280-281,284-286,289,291,295-296,298-302,321,323,327-332,334-340,346-347
890 atoms, 866 bonds, 111 residues, 1 model selected
> mutationscores define
> Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean fromScoreName
> Morphine_emax combine mean ranges "Surface_effect >= -0.233 and
> Surface_effect <= 0.66 and Morphine_emax >= -0.402 and Morphine_emax <=
> 0.0591"
Defined score Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean
having range -0.402 to -0.0867 for 113 residues using 403 mutations
Set attribute Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean for
111 residues of chain #1/R
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.0867,white:-0.176,#ff7f7f:-0.265,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> ui tool show "Render/Select by Attribute"
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #!1 target
> sabc palette -0.401859,white:-0.280811,#ff7f7f:-0.169295,red
7046 atoms, 894 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> select clear
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401859,white:-0.280811,#ff7f7f:-0.169295,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401859,white:-0.280811,#ff7f7f:-0.169295,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401859,white:-0.280811,#ff7f7f:-0.169295,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401859,white:-0.280811,#ff7f7f:-0.169295,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> ui tool show "Render/Select by Attribute"
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #!1 target
> sabc palette -0.265236,red:-0.175961,#ff7f7f:-0.0866856,white noValueColor
> #faffff
7046 atoms, 894 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #!1 target
> sabc palette -0.399317,white:-0.289072,#ff7f7f:-0.202974,red noValueColor
> #faffff
7046 atoms, 894 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #!1 target
> sabc palette -0.399317,white:-0.256664,#ff7f7f:-0.168024,red noValueColor
> #faffff
7046 atoms, 894 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> ui tool show "Render/Select by Attribute"
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #!1 target
> sabc palette -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor
> #faffff
7046 atoms, 894 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #!1 target
> sabc palette -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor
> #faffff
7046 atoms, 894 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean #1/R palette
> -0.275025,white:-0.144407,#ff7f7f:-0.0266222,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.278_0.192_Surface_effect_-0.241_0.315_mean range -0.277 to
0.0504
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
#### Deleted thousands of lines to stay within Trac limit.
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute
> r:DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count #1/R palette
> 1,#f2f5f2:5,#f58885:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count range 1 to 17
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count #1/R palette
> 1,#f2f5f2:5,#f58885:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count range 1 to 17
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count #1/R palette
> 1,#f2f5f2:5,#f58885:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count range 1 to 17
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute r:Fentanyl_ec50_0.941_3.82_Morphine_ec50_5.13_7.69_count
> #1/R palette 1,white:1.49,#7f7fff:1.98,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_0.941_3.82_Morphine_ec50_5.13_7.69_count range 1 to 3
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute r:DAMGO_ec50_2.73_5.93_Surface_effect_-0.234_0.592_count
> #1/R palette 1,white:6.77,#7f7fff:12.5,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.73_5.93_Surface_effect_-0.234_0.592_count range 1 to 19
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count range 1 to 15
> color byattribute r:DAMGO_ec50_2.73_5.93_Surface_effect_-0.234_0.592_count
> #1/R palette 1,white:6.77,#7f7fff:12.5,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.73_5.93_Surface_effect_-0.234_0.592_count range 1 to 19
> color byattribute
> r:DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count #1/R palette
> 1,#f2f5f2:5,#f58885:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count range 1 to 17
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> lighting shadows false
> graphics silhouettes true
> set bgColor white
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count #1/R palette
> 1,white:5,#ff7f7f:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count range 1 to 17
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count #1/R palette
> 1,white:5,#ff7f7f:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count range 1 to 17
> color byattribute
> r:DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count #1/R palette
> 1,#f2f5f2:5,#f58885:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count range 1 to 17
> color byattribute
> r:Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count #1/R palette
> 1,white:5,#ff7f7f:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count range 1 to 17
> color byattribute
> r:Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count #1/R palette
> 1,#f5f3f3:6,#ffa4a3:12,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count range 1 to 16
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count #1/R palette
> 1,#f5f3f3:6,#ffa4a3:12,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count range 1 to 16
> color byattribute
> r:Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean #1/R palette
> -0.401873,white:-0.249038,#ff7f7f:-0.17565,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.402_0.0591_Surface_effect_-0.233_0.66_mean range -0.402 to
-0.0867
> color byattribute
> r:Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count #1/R palette
> 1,#f5f3f3:6,#ffa4a3:12,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count range 1 to 16
> color byattribute
> r:Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count #1/R palette
> 1,white:5,#ff7f7f:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count range 1 to 17
> color byattribute
> r:Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count #1/R palette
> 1,#f5f3f3:6,#ffa4a3:12,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count range 1 to 16
> color byattribute
> r:Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count #1/R palette
> 1,white:5,#ff7f7f:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count range 1 to 17
> color byattribute
> r:DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count #1/R palette
> 1,#f2f5f2:5,#f58885:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
DAMGO_emin_-0.352_0.618_Surface_effect_-0.225_0.673_count range 1 to 17
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute r:DAMGO_ec50_2.73_5.93_Surface_effect_-0.234_0.592_count
> #1/R palette 1,white:6.77,#7f7fff:12.5,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.73_5.93_Surface_effect_-0.234_0.592_count range 1 to 19
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.73_7.77_Surface_effect_-0.234_0.429_count range 1 to 15
> color byattribute
> r:Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count range 1 to 15
> color byattribute
> r:Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count range 1 to 15
> color byattribute
> r:DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute #1/R palette
> 2.68,white:26,#7f7fff:49.4,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.67_6.26_Surface_effect_-0.233_0.74_sum_absolute range 2.68 to
74.9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count range 1 to 15
> color byattribute
> r:Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count range 1 to 15
> color byattribute
> r:Fentanyl_emax_-0.351_0.0992_Morphine_emax_-0.71_-0.403_count #1/R palette
> 1,white:4.79,#ff7f7f:8.58,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.351_0.0992_Morphine_emax_-0.71_-0.403_count range 1 to 13
> color byattribute
> r:Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count range 1 to 15
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count #1/R palette
> 1,#f5f3f3:6,#ffa4a3:12,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count range 1 to 16
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count #1/R palette
> 1,#f5f3f3:6,#ffa4a3:12,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count range 1 to 16
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count #1/R palette
> 1,#f5f3f3:6,#ffa4a3:12,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count range 1 to 16
> color byattribute
> r:Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count #1/R palette
> 1,white:5.45,#7f7fff:9.9,blue noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_ec50_5.13_7.41_Surface_effect_-0.237_0.393_count range 1 to 15
> color byattribute
> r:Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count #1/R palette
> 1,#f5f3f3:6,#ffa4a3:12,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count range 1 to 16
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute
> r:Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count #1/R palette
> 1,white:5,#ff7f7f:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count range 1 to 17
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute
> r:Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count #1/R palette
> 1,white:5,#ff7f7f:10,red noValueColor #faffff
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.35_0.283_Surface_effect_-0.233_0.644_count range 1 to 17
> select clear
[Repeated 3 time(s)]
> select
> /R:89,107,112,126,135,149,155,159,166,173,182,186,203,207,220,250,262,289,293,295,298-299,301-303,321,324-325,327-328,336-337,345
277 atoms, 262 bonds, 33 residues, 1 model selected
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> select clear
> color byattribute
> r:Fentanyl_emax_-0.351_0.0992_Morphine_emax_-0.71_-0.403_count #1/R palette
> 1,white:4.79,#ff7f7f:8.58,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.351_0.0992_Morphine_emax_-0.71_-0.403_count range 1 to 13
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> select /R:201
4 atoms, 3 bonds, 1 residue, 1 model selected
> select /R:197
6 atoms, 5 bonds, 1 residue, 1 model selected
> select /R:174
7 atoms, 7 bonds, 1 residue, 1 model selected
> select /R:280
8 atoms, 7 bonds, 1 residue, 1 model selected
> select /R:261
8 atoms, 7 bonds, 1 residue, 1 model selected
> color byattribute
> r:Fentanyl_emax_-0.351_0.0992_Morphine_emax_-0.71_-0.403_count #1/R palette
> 1,white:4.79,#ff7f7f:8.58,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.351_0.0992_Morphine_emax_-0.71_-0.403_count range 1 to 13
> select /R:327
4 atoms, 3 bonds, 1 residue, 1 model selected
> select /R:328
12 atoms, 12 bonds, 1 residue, 1 model selected
> select /R:149-150,153,242,246,295,297-299,327
83 atoms, 82 bonds, 10 residues, 1 model selected
> select /R:149-150,153,179,235,298-299,302,308,324
85 atoms, 79 bonds, 10 residues, 1 model selected
> select /R:149-150,153,179,235,242,295,298-299,302,327
93 atoms, 88 bonds, 11 residues, 1 model selected
> select
> /R:77,122-123,125-126,135,142,145,149-150,154,186,219,243,246,298-299,321,324-325,327-329
198 atoms, 194 bonds, 23 residues, 1 model selected
> ui tool show "Render/Select by Attribute"
> color byattribute
> r:Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count #1/R palette
> 1,white:3.47,#ff7f7f:5.94,red noValueColor white
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0703_Fentanyl_emax_-0.748_-0.355_count range 1 to 9
> ui tool show "Render/Select by Attribute"
> color byattribute
> r:Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute #1/R
> palette 5.18,white:31.4,#7f7fff:57.5,blue noValueColor white
2272 atoms, 283 residues, atom
Morphine_ec50_5.18_7.38_Surface_effect_-0.237_0.592_sum_absolute range 5.18 to
87.2
> ui tool show "Render/Select by Attribute"
> color byattribute r:DAMGO_ec50_2.73_5.93_Surface_effect_-0.234_0.592_count
> #1/R palette 1,white:6.77,#7f7fff:12.5,blue noValueColor white
2272 atoms, 283 residues, atom
DAMGO_ec50_2.73_5.93_Surface_effect_-0.234_0.592_count range 1 to 19
> ui tool show "Render/Select by Attribute"
[Repeated 2 time(s)]
> color byattribute
> r:Fentanyl_emax_-0.351_0.0992_Morphine_emax_-0.71_-0.403_count #1/R palette
> 1,white:4.79,#ff7f7f:8.58,red noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_emax_-0.351_0.0992_Morphine_emax_-0.71_-0.403_count range 1 to 13
> ui tool show "Render/Select by Attribute"
> color byattribute
> r:Surface_effect_-0.234_0.592_DAMGO_ec50_2.73_5.93_sum_absolute #1/R palette
> 0.00276414,white:1.49618,#7f7fff:2.43921,blue noValueColor white
2272 atoms, 283 residues, atom
Surface_effect_-0.234_0.592_DAMGO_ec50_2.73_5.93_sum_absolute range 0.00276 to
3.16
> ui tool show "Render/Select by Attribute"
> mutationscores define
> Boltz2_Fentanyl_affinity_-1.01_0.446_Fentanyl_emax_-0.241_0.131_mean
> fromScoreName Boltz2_Fentanyl_affinity combine mean ranges
> "Boltz2_Fentanyl_affinity >= -1.01 and Boltz2_Fentanyl_affinity <= 0.446 and
> Fentanyl_emax >= -0.241 and Fentanyl_emax <= 0.131"
Defined score
Boltz2_Fentanyl_affinity_-1.01_0.446_Fentanyl_emax_-0.241_0.131_mean having
range -0.998 to -0.0799 for 22 residues using 72 mutations
Set attribute
Boltz2_Fentanyl_affinity_-1.01_0.446_Fentanyl_emax_-0.241_0.131_mean for 22
residues of chain #1/R
> color byattribute
> r:Boltz2_Fentanyl_affinity_-1.01_0.446_Fentanyl_emax_-0.241_0.131_mean #1/R
> palette -0.0799,white:-0.369,#7f7fff:-0.659,blue noValueColor white
2272 atoms, 283 residues, atom
Boltz2_Fentanyl_affinity_-1.01_0.446_Fentanyl_emax_-0.241_0.131_mean range
-0.998 to -0.0799
> color byattribute
> r:Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute #1/R
> palette 5.90102,white:25.2183,#7f7fff:42.1843,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_5.9_8.32_Surface_effect_-0.239_0.484_sum_absolute range 5.9 to
81.7
> color byattribute r:Fentanyl_ec50_0.941_3.82_Morphine_ec50_5.13_7.69_count
> #1/R palette 1,white:1.49,#7f7fff:1.98,blue noValueColor white
2272 atoms, 283 residues, atom
Fentanyl_ec50_0.941_3.82_Morphine_ec50_5.13_7.69_count range 1 to 3
> ui tool show "Render/Select by Attribute"
> color byattribute
> r:Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count #1/R palette
> 1,#f5f3f3:6,#ffa4a3:12,red noValueColor #faffff
2272 atoms, 283 residues, atom
Morphine_emax_-0.398_0.0811_Surface_effect_-0.236_0.655_count range 1 to 16
> ui tool show "Render/Select by Attribute"
Traceback (most recent call last):
File
"/Applications/ChimeraX-1.11-rc2025.11.27.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/ui/widgets/color_button.py", line 159, in
color_to_numpy_rgba8
color = BuiltinColors[color]
~~~~~~~~~~~~~^^^^^^^
KeyError: '#faffff'
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File
"/Applications/ChimeraX-1.11-rc2025.11.27.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/mutation_scores/ms_color_history.py", line 218, in
_adjust_colors
_show_render_by_attribute_panel(self.session, mset, attribute_name,
File
"/Applications/ChimeraX-1.11-rc2025.11.27.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/mutation_scores/ms_scatter_plot.py", line 777, in
_show_render_by_attribute_panel
rba_gui.no_value_color.color = no_value_color
^^^^^^^^^^^^^^^^^^^^^^^^^^^^
File
"/Applications/ChimeraX-1.11-rc2025.11.27.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/ui/widgets/color_button.py", line 82, in set_color
rgba = color_to_numpy_rgba8(color)
^^^^^^^^^^^^^^^^^^^^^^^^^^^
File
"/Applications/ChimeraX-1.11-rc2025.11.27.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/ui/widgets/color_button.py", line 161, in
color_to_numpy_rgba8
raise ValueError("'%s' is not a built-in color name" % color)
ValueError: '#faffff' is not a built-in color name
ValueError: '#faffff' is not a built-in color name
File
"/Applications/ChimeraX-1.11-rc2025.11.27.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-
packages/chimerax/ui/widgets/color_button.py", line 161, in
color_to_numpy_rgba8
raise ValueError("'%s' is not a built-in color name" % color)
See log for complete Python traceback.
> save "/Users/willowcoyote-maestas/Library/CloudStorage/Box-Box/WCM
> Lab/Willow/MOR_analysis/012026/mor_scores_012126.cxs"
OpenGL version: 4.1 Metal - 89.4
OpenGL renderer: Apple M1 Pro
OpenGL vendor: Apple
Python: 3.11.9
Locale: en_US.UTF-8
Qt version: PyQt6 6.9.1, Qt 6.9.0
Qt runtime version: 6.9.2
Qt platform: cocoa
Hardware:
Hardware Overview:
Model Name: MacBook Pro
Model Identifier: MacBookPro18,3
Model Number: MKGQ3LL/A
Chip: Apple M1 Pro
Total Number of Cores: 10 (8 performance and 2 efficiency)
Memory: 16 GB
System Firmware Version: 13822.61.10
OS Loader Version: 11881.140.96
Software:
System Software Overview:
System Version: macOS 15.7.3 (24G419)
Kernel Version: Darwin 24.6.0
Time since boot: 10 days, 10 hours, 10 minutes
Graphics/Displays:
Apple M1 Pro:
Chipset Model: Apple M1 Pro
Type: GPU
Bus: Built-In
Total Number of Cores: 16
Vendor: Apple (0x106b)
Metal Support: Metal 3
Displays:
Color LCD:
Display Type: Built-in Liquid Retina XDR Display
Resolution: 3024 x 1964 Retina
Main Display: Yes
Mirror: Off
Online: Yes
Automatically Adjust Brightness: Yes
Connection Type: Internal
Installed Packages:
aiohappyeyeballs: 2.6.1
aiohttp: 3.13.1
aiosignal: 1.4.0
alabaster: 1.0.0
annotated-types: 0.7.0
anyio: 4.11.0
appdirs: 1.4.4
appnope: 0.1.4
asttokens: 3.0.1
attrs: 25.4.0
babel: 2.17.0
beautifulsoup4: 4.13.5
blockdiag: 3.0.0
blosc2: 3.11.1
build: 1.3.0
certifi: 2025.7.14
cftime: 1.6.5
charset-normalizer: 3.4.4
ChimeraX-AddCharge: 1.5.20
ChimeraX-AddH: 2.2.8
ChimeraX-AlignmentAlgorithms: 2.0.2
ChimeraX-AlignmentHdrs: 3.6.1
ChimeraX-AlignmentMatrices: 2.1
ChimeraX-Alignments: 3.1.1
ChimeraX-AlphaFold: 1.0.1
ChimeraX-AltlocExplorer: 1.2
ChimeraX-AmberInfo: 1.0
ChimeraX-Animations: 1.0
ChimeraX-Aniso: 1.3.2
ChimeraX-Arrays: 1.1
ChimeraX-Atomic: 1.61.4
ChimeraX-AtomicLibrary: 14.2.1
ChimeraX-AtomSearch: 2.0.1
ChimeraX-AxesPlanes: 2.4
ChimeraX-BasicActions: 1.1.3
ChimeraX-BILD: 1.0
ChimeraX-BlastProtein: 3.0.0
ChimeraX-Boltz: 1.1
ChimeraX-BondRot: 2.0.4
ChimeraX-BugReporter: 1.0.2
ChimeraX-BuildStructure: 2.13.1
ChimeraX-Bumps: 1.0
ChimeraX-BundleBuilder: 1.6.0
ChimeraX-ButtonPanel: 1.0.1
ChimeraX-CageBuilder: 1.0.1
ChimeraX-CellPack: 1.0
ChimeraX-Centroids: 1.4
ChimeraX-ChangeChains: 1.1
ChimeraX-CheckWaters: 1.5
ChimeraX-ChemGroup: 2.0.2
ChimeraX-Clashes: 2.3
ChimeraX-ColorActions: 1.0.5
ChimeraX-ColorGlobe: 1.0
ChimeraX-ColorKey: 1.5.8
ChimeraX-CommandLine: 1.3.0
ChimeraX-ConnectStructure: 2.0.1
ChimeraX-Contacts: 1.0.1
ChimeraX-Core: 1.11rc202511270036
ChimeraX-CoreFormats: 1.2
ChimeraX-coulombic: 1.4.5
ChimeraX-Crosslinks: 1.0
ChimeraX-Crystal: 1.0
ChimeraX-CrystalContacts: 1.0.1
ChimeraX-DataFormats: 1.2.4
ChimeraX-Dicom: 1.2.7
ChimeraX-DistMonitor: 1.4.2
ChimeraX-DockPrep: 1.1.4
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: 1.4.1
ChimeraX-Hbonds: 2.5.3
ChimeraX-Help: 1.3
ChimeraX-HKCage: 1.3
ChimeraX-IHM: 1.1
ChimeraX-ImageFormats: 1.2
ChimeraX-IMOD: 1.0
ChimeraX-IO: 1.0.4
ChimeraX-ItemsInspection: 1.0.1
ChimeraX-IUPAC: 1.0
ChimeraX-KVFinder: 1.7.2
ChimeraX-Label: 1.2
ChimeraX-ListInfo: 1.2.2
ChimeraX-Log: 1.2.2
ChimeraX-LookingGlass: 1.1
ChimeraX-Maestro: 1.9.2
ChimeraX-Map: 1.3
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: 2.2.2
ChimeraX-MCopy: 1.0
ChimeraX-MCPServer: 0.1.0
ChimeraX-MDcrds: 2.17.2
ChimeraX-MedicalToolbar: 1.1
ChimeraX-Meeting: 1.0.1
ChimeraX-Minimize: 1.3.2
ChimeraX-MLP: 1.1.1
ChimeraX-mmCIF: 2.16
ChimeraX-MMTF: 2.2
ChimeraX-ModelArchive: 1.0
ChimeraX-Modeller: 1.5.22
ChimeraX-ModelPanel: 1.6
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: 1.0.1
ChimeraX-MutationScores: 1.0
ChimeraX-Neuron: 1.0
ChimeraX-Nifti: 1.2
ChimeraX-NMRSTAR: 1.0.2
ChimeraX-NRRD: 1.2
ChimeraX-Nucleotides: 2.0.3
ChimeraX-OpenCommand: 1.15.2
ChimeraX-OrthoPick: 1.0.1
ChimeraX-PDB: 2.7.11
ChimeraX-PDBBio: 1.0.1
ChimeraX-PDBLibrary: 1.0.5
ChimeraX-PDBMatrices: 1.0
ChimeraX-PickBlobs: 1.0.1
ChimeraX-Positions: 1.0
ChimeraX-PresetMgr: 1.1.4
ChimeraX-ProfileGrids: 1.4.1
ChimeraX-PubChem: 2.2
ChimeraX-ReadPbonds: 1.0.1
ChimeraX-Registration: 1.1.2
ChimeraX-RemoteControl: 1.0
ChimeraX-RenderByAttr: 1.6.5
ChimeraX-RenumberResidues: 1.1
ChimeraX-ResidueFit: 1.0.1
ChimeraX-RestServer: 1.3.3
ChimeraX-RNALayout: 1.0
ChimeraX-RotamerLibMgr: 4.0
ChimeraX-RotamerLibsDunbrack: 2.0
ChimeraX-RotamerLibsDynameomics: 2.0
ChimeraX-RotamerLibsRichardson: 2.0
ChimeraX-SaveCommand: 1.5.2
ChimeraX-Scenes: 0.3.1
ChimeraX-SchemeMgr: 1.0
ChimeraX-SDF: 2.0.3
ChimeraX-Segger: 1.0
ChimeraX-Segment: 1.0.1
ChimeraX-Segmentations: 3.5.10
ChimeraX-SelInspector: 1.0
ChimeraX-SeqView: 2.17.3
ChimeraX-Shape: 1.1
ChimeraX-Shell: 1.0.1
ChimeraX-Shortcuts: 1.2.1
ChimeraX-ShowSequences: 1.0.3
ChimeraX-SideView: 1.0.1
ChimeraX-SimilarStructures: 1.0.1
ChimeraX-Smiles: 2.1.2
ChimeraX-SmoothLines: 1.0
ChimeraX-SpaceNavigator: 1.0
ChimeraX-StdCommands: 1.19.1
ChimeraX-STL: 1.0.1
ChimeraX-Storm: 1.0
ChimeraX-StructMeasure: 1.2.1
ChimeraX-Struts: 1.0.1
ChimeraX-Surface: 1.0.1
ChimeraX-SwapAA: 2.0.1
ChimeraX-SwapRes: 2.5.2
ChimeraX-TapeMeasure: 1.0
ChimeraX-TaskManager: 1.0
ChimeraX-Test: 1.0
ChimeraX-Toolbar: 1.2.3
ChimeraX-ToolshedUtils: 1.2.4
ChimeraX-Topography: 1.0
ChimeraX-ToQuest: 1.0
ChimeraX-Tug: 1.0.1
ChimeraX-UI: 1.49.1
ChimeraX-Umap: 1.0
ChimeraX-uniprot: 2.3.2
ChimeraX-UnitCell: 1.0.1
ChimeraX-ViewDock: 1.5.2
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: 1.1.5
ChimeraX-Zone: 1.0.1
click: 8.3.1
colorama: 0.4.6
comm: 0.2.3
contourpy: 1.3.3
coverage: 7.12.0
cxservices: 1.2.3
cycler: 0.12.1
Cython: 3.1.4
debugpy: 1.8.17
decorator: 5.2.1
docutils: 0.21.2
executing: 2.2.1
filelock: 3.19.1
fonttools: 4.60.1
frozenlist: 1.8.0
funcparserlib: 2.0.0a0
glfw: 2.10.0
grako: 3.16.5
h11: 0.16.0
h5py: 3.15.1
html2text: 2025.4.15
httpcore: 1.0.9
httpx: 0.28.1
httpx-sse: 0.4.3
idna: 3.11
ihm: 2.2
imagecodecs: 2024.6.1
imagesize: 1.4.1
iniconfig: 2.3.0
ipykernel: 6.30.1
ipython: 9.5.0
ipython_pygments_lexers: 1.1.1
ipywidgets: 8.1.8
jedi: 0.19.2
Jinja2: 3.1.6
jsonschema: 4.25.1
jsonschema-specifications: 2025.9.1
jupyter_client: 8.6.3
jupyter_core: 5.9.1
jupyterlab_widgets: 3.0.16
kiwisolver: 1.4.9
line_profiler: 5.0.0
lxml: 6.0.2
lz4: 4.3.2
Markdown: 3.8.2
MarkupSafe: 3.0.3
matplotlib: 3.10.7
matplotlib-inline: 0.2.1
mcp: 1.18.0
msgpack: 1.1.1
multidict: 6.7.0
ndindex: 1.10.1
nest-asyncio: 1.6.0
netCDF4: 1.6.5
networkx: 3.3
nibabel: 5.2.0
nptyping: 2.5.0
numexpr: 2.14.1
numpy: 1.26.4
OpenMM: 8.2.0
openvr: 1.26.701
packaging: 25.0
ParmEd: 4.2.2
parso: 0.8.5
pep517: 0.13.1
pexpect: 4.9.0
pickleshare: 0.7.5
pillow: 11.3.0
pip: 25.2
pkginfo: 1.12.1.2
platformdirs: 4.5.0
pluggy: 1.6.0
prompt_toolkit: 3.0.52
propcache: 0.4.1
psutil: 7.0.0
ptyprocess: 0.7.0
pure_eval: 0.2.3
py-cpuinfo: 9.0.0
pybind11: 3.0.1
pycollada: 0.8
pydantic: 2.12.5
pydantic-settings: 2.12.0
pydantic_core: 2.41.5
pydicom: 2.4.4
Pygments: 2.18.0
pynmrstar: 3.3.6
pynrrd: 1.0.0
PyOpenGL: 3.1.10
PyOpenGL-accelerate: 3.1.10
pyopenxr: 1.1.4501
pyparsing: 3.2.5
pyproject_hooks: 1.2.0
PyQt6-commercial: 6.9.1
PyQt6-Qt6: 6.9.2
PyQt6-WebEngine-commercial: 6.9.0
PyQt6-WebEngine-Qt6: 6.9.2
PyQt6_sip: 13.10.2
pytest: 9.0.1
pytest-cov: 7.0.0
python-dateutil: 2.9.0.post0
python-dotenv: 1.2.1
python-multipart: 0.0.20
pytz: 2025.2
pyzmq: 27.1.0
qtconsole: 5.7.0
QtPy: 2.4.3
qtshim: 1.2
RandomWords: 0.4.0
referencing: 0.37.0
requests: 2.32.5
roman-numerals-py: 3.1.0
rpds-py: 0.29.0
scipy: 1.14.0
setuptools: 80.9.0
sfftk-rw: 0.8.1
six: 1.17.0
sniffio: 1.3.1
snowballstemmer: 3.0.1
sortedcontainers: 2.4.0
soupsieve: 2.8
Sphinx: 8.2.3
sphinx-autodoc-typehints: 3.2.0
sphinxcontrib-applehelp: 2.0.0
sphinxcontrib-blockdiag: 3.0.0
sphinxcontrib-devhelp: 2.0.0
sphinxcontrib-htmlhelp: 2.1.0
sphinxcontrib-jsmath: 1.0.1
sphinxcontrib-qthelp: 2.0.0
sphinxcontrib-serializinghtml: 2.0.0
sse-starlette: 3.0.3
stack-data: 0.6.3
starlette: 0.50.0
superqt: 0.7.6
tables: 3.10.2
tcia_utils: 1.5.1
tifffile: 2025.3.13
tinyarray: 1.2.5
tornado: 6.5.2
traitlets: 5.14.3
typing-inspection: 0.4.2
typing_extensions: 4.15.0
tzdata: 2025.2
urllib3: 2.5.0
uvicorn: 0.38.0
wcwidth: 0.2.14
webcolors: 24.11.1
wheel: 0.45.1
wheel-filename: 1.4.2
widgetsnbextension: 4.0.15
yarl: 1.22.0
File attachment: mor_scores_012126.cxs
|
|||
| #19757 | duplicate | Crash in swap_buffers exposing status line during Mac wakeup, macOS 26.2 | ||
| Description |
The following bug report has been submitted:
Platform: macOS-26.2-arm64-arm-64bit
ChimeraX Version: 1.11 (2025-12-17 06:45:39 UTC)
Description
Last time you used ChimeraX it crashed.
Please describe steps that led to the crash here.
Fatal Python error: Bus error
Current thread 0x00000001f74bac40 (most recent call first):
File "/Applications/ChimeraX-1.11.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/graphics/opengl.py", line 248 in swap_buffers
File "/Applications/ChimeraX-1.11.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/graphics/opengl.py", line 561 in swap_buffers
File "/Applications/ChimeraX-1.11.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/ui/statusbar.py", line 166 in status
File "/Applications/ChimeraX-1.11.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/ui/statusbar.py", line 98 in _expose_event
File "/Applications/ChimeraX-1.11.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/ui/gui.py", line 414 in event_loop
File "/Applications/ChimeraX-1.11.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py", line 1064 in init
File "/Applications/ChimeraX-1.11.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py", line 1229 in
File "", line 88 in _run_code
File "", line 198 in _run_module_as_main
Extension modules: chimerax.arrays._arrays, numpy.core._multiarray_umath, numpy.core._multiarray_tests, numpy.linalg._umath_linalg, numpy.fft._pocketfft_internal, numpy.random._common, numpy.random.bit_generator, numpy.random._bounded_integers, numpy.random._mt19937, numpy.random.mtrand, numpy.random._philox, numpy.random._pcg64, numpy.random._sfc64, numpy.random._generator, chimerax.geometry._geometry, PyQt6.QtCore, PyQt6.QtGui, PyQt6.QtWidgets, PyQt6.QtNetwork, PyQt6.QtPrintSupport, PyQt6.QtWebChannel, PyQt6.QtWebEngineCore, PyQt6.QtWebEngineWidgets, chimerax.atomic_lib._load_libs, tinyarray, chimerax.atomic.cymol, chimerax.atomic.cytmpl, chimerax.map._map, psutil._psutil_osx, psutil._psutil_posix, chimerax.surface._surface, chimerax.pdb_lib._load_libs, PIL._imaging, OpenGL_accelerate.errorchecker, OpenGL_accelerate.wrapper, OpenGL_accelerate.formathandler, OpenGL_accelerate.arraydatatype, OpenGL_accelerate.latebind, OpenGL_accelerate.vbo, chimerax.core._mac_util, OpenGL_accelerate.numpy_formathandler, OpenGL_accelerate.nones_formathandler, lz4._version, lz4.frame._frame, msgpack._cmsgpack, chimerax.core._serialize, PyQt6.QtOpenGL, PyQt6.QtOpenGLWidgets, chimerax.graphics._graphics, chimerax.atomic._ribbons, chimerax.mmcif._mmcif, chimerax.mmcif.mmcif, chimerax.pdb._pdbio, lxml._elementpath, lxml.etree, PIL._imagingmath, chimerax.alignment_algs._sw, chimerax.dssp._dssp, chimerax.alignment_algs._nw (total: 59)
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===== Log before crash start =====
UCSF ChimeraX version: 1.11 (2025-12-17)
© 2016-2025 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
> open
> /Users/pc126390/Integrative_Modelling/Projet_DMC1/transfer_11636725_files_2946497c/BRCA2map.cxs
Opened cryosparc_P26_J759_009_volume_map.mrc as #1, grid size 336,336,336,
pixel 0.745, shown at level 0.0137, step 2, values float32
Opened cryosparc_P26_J780_map_locres.mrc as #2, grid size 336,336,336, pixel
0.745, shown at level 6.08, step 2, values float32
> view name session-start
opened ChimeraX session
> select /A
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> volume #1 step 1
> volume #1 style mesh
> graphics silhouettes false
> select #1/X
Nothing selected
> select #1/X
Nothing selected
> show atoms
> hide atoms
> select #3/X
360 atoms, 395 bonds, 18 residues, 1 model selected
> show sel atoms
> style sel ball
Changed 360 atom styles
> select #3/E
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> rainbow sel
> select #3/C
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> rainbow sel
> select #3/X
360 atoms, 395 bonds, 18 residues, 1 model selected
> sequence chain #3/X
Alignment identifier is 3/X
> select #3/O
66 atoms, 69 bonds, 8 residues, 1 model selected
> show sel atoms
> sequence chain #3/O
Alignment identifier is 3/O
> select #3/O
66 atoms, 69 bonds, 8 residues, 1 model selected
> view sel
> select zone sel 4.5 #1/C residues true
No target atoms or surfaces
> select zone sel 4.5 #3/C residues true
Selected 99 atoms
> show sel atoms
> style sel ball
Changed 99 atom styles
> color sel bychain
> color sel byhetero
> hide sel cartoons
> select #3/C
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> hide sel cartoons
> show sel atoms
> style sel ball
Changed 2485 atom styles
> color sel byhetero
> show sel cartoons
> view #3 clip false
> select #3/C
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> color sel bychain
> color sel byhetero
> select #3
15583 atoms, 15863 bonds, 11 pseudobonds, 1971 residues, 3 models selected
> color sel bychain
> select #3/C
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> color sel byhetero
> select #3/D
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> show sel atoms
> style sel ball
Changed 2485 atom styles
> open 1V5W
Summary of feedback from opening 1V5W fetched from pdb
---
note | Fetching compressed mmCIF 1v5w from http://files.rcsb.org/download/1v5w.cif
1v5w title:
Crystal structure of the human Dmc1 protein [more info...]
Chain information for 1v5w #4
---
Chain | Description | UniProt
A B | Meiotic recombination protein DMC1/LIM15 homolog | DMC1_HUMAN 1-340
1v5w mmCIF Assemblies
---
1| author_and_software_defined_assembly
2| software_defined_assembly
> hide #!3 models
> view #4 clip false
> open /Users/pc126390/Integrative_Modelling/Projet_DMC1/1V5W-assembly1.cif
1V5W-assembly1.cif title:
Crystal structure of the human Dmc1 protein [more info...]
Chain information for 1V5W-assembly1.cif #5
---
Chain | Description
A A-2 A-3 A-4 B B-2 B-3 B-4 | Meiotic recombination protein DMC1/LIM15 homolog
> hide #!4 models
> hide #!5 atoms
> show #!5 cartoons
> open 8QQE
Summary of feedback from opening 8QQE fetched from pdb
---
note | Fetching compressed mmCIF 8qqe from http://files.rcsb.org/download/8qqe.cif
8qqe title:
Crystal structure of the complex between DMC1 and the PhePP domain of BRCA2
[more info...]
Chain information for 8qqe #6
---
Chain | Description | UniProt
A B | Meiotic recombination protein DMC1/LIM15 homolog | DMC1_HUMAN 2-340
C D | Breast cancer type 2 susceptibility protein | BRCA2_HUMAN 1398-1417 2398-2417
Non-standard residues in 8qqe #6
---
CL — chloride ion
MG — magnesium ion
8qqe mmCIF Assemblies
---
1| author_defined_assembly
39 atoms have alternate locations. Control/examine alternate locations with
Altloc Explorer [start tool...] or the altlocs command.
4377 atoms have anisotropic B-factors. Depict anisotropic information with
Thermal Ellipsoids [start tool...] or the aniso command.
> close #6
> close #5
> close #4
> open /Users/pc126390/Integrative_Modelling/Projet_DMC1/8QQE-assembly1.cif
8QQE-assembly1.cif title:
Crystal structure of the complex between DMC1 and the PhePP domain of BRCA2
[more info...]
Chain information for 8QQE-assembly1.cif #4
---
Chain | Description
A A-2 A-3 A-4 B B-2 B-3 B-4 | Meiotic recombination protein DMC1/LIM15 homolog
C C-2 C-3 C-4 D D-2 D-3 D-4 | Breast cancer type 2 susceptibility protein
Non-standard residues in 8QQE-assembly1.cif #4
---
CL — chloride ion
MG — magnesium ion
156 atoms have alternate locations. Control/examine alternate locations with
Altloc Explorer [start tool...] or the altlocs command.
17508 atoms have anisotropic B-factors. Depict anisotropic information with
Thermal Ellipsoids [start tool...] or the aniso command.
> hide #!4 atoms
> show #!4 cartoons
> color #!4 bychain
> mmaker #4/A to #3/C
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker BRCA2L-J759_m1_real_space_refined_001.pdb, chain C (#3) with 8QQE-
assembly1.cif, chain A (#4), sequence alignment score = 1514.3
RMSD between 222 pruned atom pairs is 0.707 angstroms; (across all 296 pairs:
8.936)
> view #3/C
> show #!3 models
> hide #!3 models
> show #!3 models
> view #4/D
> select #4/D
39 atoms, 41 bonds, 5 residues, 1 model selected
> show sel atoms
> style sel ball
Changed 39 atom styles
> hide #!3 models
> mmaker #4/B to #3/C
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker BRCA2L-J759_m1_real_space_refined_001.pdb, chain C (#3) with 8QQE-
assembly1.cif, chain B (#4), sequence alignment score = 1453.7
RMSD between 222 pruned atom pairs is 0.703 angstroms; (across all 247 pairs:
2.555)
> show #!3 models
> view #4/B
> hide #!3 models
> show #!3 models
> hide #!4 models
> view #3/C
> select #3/C
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> sequence chain #3/C
Alignment identifier is 3/C
> ui tool show "Selection Inspector"
> select #3/X
360 atoms, 395 bonds, 18 residues, 1 model selected
> save /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_structs.cxs
> show #!1 models
> show #!2 models
> show #!4 models
> hide #!1 models
> hide #!2 models
> hide #!4 models
> select #3/A
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> select #3/A
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> save /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_A.pdb models #3
> selectedOnly true
> select #3/B
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> save /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_B.pdb models #3
> selectedOnly true
> select #3/C
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> save /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_C.pdb models #3
> selectedOnly true
> select #3/D
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> save /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_D.pdb models #3
> selectedOnly true
> select #3/E
2485 atoms, 2523 bonds, 2 pseudobonds, 319 residues, 3 models selected
> save /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_E.pdb models #3
> selectedOnly true
> select #3/F
2438 atoms, 2476 bonds, 1 pseudobond, 314 residues, 2 models selected
> save /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_F.pdb models #3
> selectedOnly true
> select #3/O
66 atoms, 69 bonds, 8 residues, 1 model selected
> save /Users/pc126390/Integrative_Modelling/Projet_DMC1/brca2_O.pdb models #3
> selectedOnly true
> open /Users/pc126390/Integrative_Modelling/Projet_DMC1/brca2_O.pdb
> /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_A.pdb
> /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_B.pdb
> /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_C.pdb
> /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_D.pdb
> /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_E.pdb
> /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_F.pdb
Summary of feedback from opening
/Users/pc126390/Integrative_Modelling/Projet_DMC1/brca2_O.pdb
---
warnings | Start residue of secondary structure not found: HELIX 1 1 ILE A 24 HIS A 30 1 7
Start residue of secondary structure not found: HELIX 2 2 VAL A 34 VAL A 43 1
10
Start residue of secondary structure not found: HELIX 3 3 ILE A 48 MET A 53 1
6
Start residue of secondary structure not found: HELIX 4 4 ARG A 56 ASN A 61 1
6
Start residue of secondary structure not found: HELIX 5 5 GLU A 67 LEU A 80 1
14
151 messages similar to the above omitted
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Summary of feedback from opening
/Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_A.pdb
---
warnings | Start residue of secondary structure not found: HELIX 16 16 ILE B 24 HIS B 30 1 7
Start residue of secondary structure not found: HELIX 17 17 VAL B 34 VAL B 43
1 10
Start residue of secondary structure not found: HELIX 18 18 ILE B 48 MET B 53
1 6
Start residue of secondary structure not found: HELIX 19 19 ARG B 56 ASN B 61
1 6
Start residue of secondary structure not found: HELIX 20 20 GLU B 67 LEU B 80
1 14
125 messages similar to the above omitted
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Summary of feedback from opening
/Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_B.pdb
---
warnings | Start residue of secondary structure not found: HELIX 1 1 ILE A 24 HIS A 30 1 7
Start residue of secondary structure not found: HELIX 2 2 VAL A 34 VAL A 43 1
10
Start residue of secondary structure not found: HELIX 3 3 ILE A 48 MET A 53 1
6
Start residue of secondary structure not found: HELIX 4 4 ARG A 56 ASN A 61 1
6
Start residue of secondary structure not found: HELIX 5 5 GLU A 67 LEU A 80 1
14
125 messages similar to the above omitted
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Summary of feedback from opening
/Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_C.pdb
---
warnings | Start residue of secondary structure not found: HELIX 1 1 ILE A 24 HIS A 30 1 7
Start residue of secondary structure not found: HELIX 2 2 VAL A 34 VAL A 43 1
10
Start residue of secondary structure not found: HELIX 3 3 ILE A 48 MET A 53 1
6
Start residue of secondary structure not found: HELIX 4 4 ARG A 56 ASN A 61 1
6
Start residue of secondary structure not found: HELIX 5 5 GLU A 67 LEU A 80 1
14
125 messages similar to the above omitted
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Summary of feedback from opening
/Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_D.pdb
---
warnings | Start residue of secondary structure not found: HELIX 1 1 ILE A 24 HIS A 30 1 7
Start residue of secondary structure not found: HELIX 2 2 VAL A 34 VAL A 43 1
10
Start residue of secondary structure not found: HELIX 3 3 ILE A 48 MET A 53 1
6
Start residue of secondary structure not found: HELIX 4 4 ARG A 56 ASN A 61 1
6
Start residue of secondary structure not found: HELIX 5 5 GLU A 67 LEU A 80 1
14
125 messages similar to the above omitted
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Summary of feedback from opening
/Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_E.pdb
---
warnings | Start residue of secondary structure not found: HELIX 1 1 ILE A 24 HIS A 30 1 7
Start residue of secondary structure not found: HELIX 2 2 VAL A 34 VAL A 43 1
10
Start residue of secondary structure not found: HELIX 3 3 ILE A 48 MET A 53 1
6
Start residue of secondary structure not found: HELIX 4 4 ARG A 56 ASN A 61 1
6
Start residue of secondary structure not found: HELIX 5 5 GLU A 67 LEU A 80 1
14
124 messages similar to the above omitted
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Summary of feedback from opening
/Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_F.pdb
---
warnings | Start residue of secondary structure not found: HELIX 1 1 ILE A 24 HIS A 30 1 7
Start residue of secondary structure not found: HELIX 2 2 VAL A 34 VAL A 43 1
10
Start residue of secondary structure not found: HELIX 3 3 ILE A 48 MET A 53 1
6
Start residue of secondary structure not found: HELIX 4 4 ARG A 56 ASN A 61 1
6
Start residue of secondary structure not found: HELIX 5 5 GLU A 67 LEU A 80 1
14
126 messages similar to the above omitted
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Chain information for brca2_O.pdb #5
---
Chain | Description
O | No description available
Chain information for dmc1_A.pdb #6
---
Chain | Description
A | No description available
Chain information for dmc1_B.pdb #7
---
Chain | Description
B | No description available
Chain information for dmc1_C.pdb #8
---
Chain | Description
C | No description available
Chain information for dmc1_D.pdb #9
---
Chain | Description
D | No description available
Chain information for dmc1_E.pdb #10
---
Chain | Description
E | No description available
Chain information for dmc1_F.pdb #11
---
Chain | Description
F | No description available
> hide #!3 models
> hide #!6 models
> show #!6 models
> hide #5 models
> show #5 models
> hide #!6 models
> show #!6 models
> hide #!7 models
> show #!7 models
> hide #!8 models
> show #!8 models
> select #3/X
360 atoms, 395 bonds, 18 residues, 1 model selected
> save /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_X.pdb models #3
> selectedOnly true
> open /Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_X.pdb
Summary of feedback from opening
/Users/pc126390/Integrative_Modelling/Projet_DMC1/dmc1_X.pdb
---
warnings | Start residue of secondary structure not found: HELIX 1 1 ILE A 24 HIS A 30 1 7
Start residue of secondary structure not found: HELIX 2 2 VAL A 34 VAL A 43 1
10
Start residue of secondary structure not found: HELIX 3 3 ILE A 48 MET A 53 1
6
Start residue of secondary structure not found: HELIX 4 4 ARG A 56 ASN A 61 1
6
Start residue of secondary structure not found: HELIX 5 5 GLU A 67 LEU A 80 1
14
151 messages similar to the above omitted
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Cannot find LINK/SSBOND residue ANP (401 )
Chain information for dmc1_X.pdb #12
---
Chain | Description
X | No description available
Computing secondary structure
> hide #5 models
> hide #!7 models
> hide #!8 models
> hide #!9 models
> hide #!10 models
> hide #!11 models
> hide #12 models
> show #!11 models
> hide #!11 models
> hide #!6 models
> show #!7 models
> hide #!7 models
> show #!7 models
> hide #!7 models
> show #!8 models
> hide #!8 models
> show #!8 models
> hide #!8 models
> show #!9 models
> hide #!9 models
> show #!10 models
> hide #!10 models
> show #!11 models
> show #!10 models
> hide #!10 models
> show #!10 models
> hide #!10 models
> show #!10 models
> show #!9 models
> show #!8 models
> show #!7 models
> show #!6 models
> select #3/A:ANP
31 atoms, 33 bonds, 1 residue, 1 model selected
> view sel
No displayed objects specified.
> select #3/A:ANP
31 atoms, 33 bonds, 1 residue, 1 model selected
> view #8/A:ANP
No objects specified.
> hide #!8 models
> show #!8 models
> hide #!8 models
> show #!8 models
> show #12 models
> hide #12 models
> show #12 models
> show #!4 models
> hide #!4 models
> show #!4 models
> hide #!6 models
> hide #!7 models
> hide #!8 models
> hide #!9 models
> hide #!10 models
> hide #!11 models
> hide #12 models
> show #!6 models
> hide #!6 models
> show #!6 models
> show #!7 models
Unsupported scale factor (0.000000) detected on Display0
===== Log before crash end =====
Log:
UCSF ChimeraX version: 1.11 (2025-12-17)
© 2016-2025 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
OpenGL version: 4.1 Metal - 90.5
OpenGL renderer: Apple M4 Max
OpenGL vendor: Apple
Python: 3.11.9
Locale: fr_FR.UTF-8
Qt version: PyQt6 6.9.1, Qt 6.9.0
Qt runtime version: 6.9.2
Qt platform: cocoa
Hardware:
Hardware Overview:
Model Name: MacBook Pro
Model Identifier: Mac16,5
Model Number: Z1FV000H9FN/A
Chip: Apple M4 Max
Total Number of Cores: 14 (10 performance and 4 efficiency)
Memory: 36 GB
System Firmware Version: 13822.61.10
OS Loader Version: 13822.61.10
Software:
System Software Overview:
System Version: macOS 26.2 (25C56)
Kernel Version: Darwin 25.2.0
Time since boot: 2 jours, 12 heures et 55 minutes
Graphics/Displays:
Apple M4 Max:
Chipset Model: Apple M4 Max
Type: GPU
Bus: Built-In
Total Number of Cores: 32
Vendor: Apple (0x106b)
Metal Support: Metal 4
Displays:
Color LCD:
Display Type: Built-in Liquid Retina XDR Display
Resolution: 3456 x 2234 Retina
Main Display: Yes
Mirror: Off
Online: Yes
Automatically Adjust Brightness: Yes
Connection Type: Internal
Studio Display:
Display Type: Retina LCD
Resolution: 5120 x 2880 Retina
Display Serial Number: LY0X41HPJ4
Display Firmware Version: Version 17.0 (Build 21A329)
Mirror: Off
Online: Yes
Automatically Adjust Brightness: Yes
Installed Packages:
aiohappyeyeballs: 2.6.1
aiohttp: 3.13.1
aiosignal: 1.4.0
alabaster: 1.0.0
annotated-types: 0.7.0
anyio: 4.12.0
appdirs: 1.4.4
appnope: 0.1.4
asttokens: 3.0.1
attrs: 25.4.0
babel: 2.17.0
beautifulsoup4: 4.13.5
blockdiag: 3.0.0
blosc2: 3.12.2
build: 1.3.0
certifi: 2025.7.14
cftime: 1.6.5
charset-normalizer: 3.4.4
ChimeraX-AddCharge: 1.5.20
ChimeraX-AddH: 2.2.8
ChimeraX-AlignmentAlgorithms: 2.0.2
ChimeraX-AlignmentHdrs: 3.6.1
ChimeraX-AlignmentMatrices: 2.1
ChimeraX-Alignments: 3.1.1
ChimeraX-AlphaFold: 1.0.1
ChimeraX-AltlocExplorer: 1.2
ChimeraX-AmberInfo: 1.0
ChimeraX-Animations: 1.0
ChimeraX-Aniso: 1.3.2
ChimeraX-Arrays: 1.1
ChimeraX-Atomic: 1.61.4
ChimeraX-AtomicLibrary: 14.2.1
ChimeraX-AtomSearch: 2.0.1
ChimeraX-AxesPlanes: 2.4
ChimeraX-BasicActions: 1.1.3
ChimeraX-BILD: 1.0
ChimeraX-BlastProtein: 3.0.0
ChimeraX-Boltz: 1.1
ChimeraX-BondRot: 2.0.4
ChimeraX-BugReporter: 1.0.2
ChimeraX-BuildStructure: 2.13.1
ChimeraX-Bumps: 1.0
ChimeraX-BundleBuilder: 1.6.0
ChimeraX-ButtonPanel: 1.0.1
ChimeraX-CageBuilder: 1.0.1
ChimeraX-CellPack: 1.0
ChimeraX-Centroids: 1.4
ChimeraX-ChangeChains: 1.1
ChimeraX-CheckWaters: 1.5
ChimeraX-ChemGroup: 2.0.2
ChimeraX-Clashes: 2.3
ChimeraX-ColorActions: 1.0.5
ChimeraX-ColorGlobe: 1.0
ChimeraX-ColorKey: 1.5.8
ChimeraX-CommandLine: 1.3.0
ChimeraX-ConnectStructure: 2.0.1
ChimeraX-Contacts: 1.0.1
ChimeraX-Core: 1.11
ChimeraX-CoreFormats: 1.2
ChimeraX-coulombic: 1.4.5
ChimeraX-Crosslinks: 1.0
ChimeraX-Crystal: 1.0
ChimeraX-CrystalContacts: 1.0.1
ChimeraX-DataFormats: 1.2.4
ChimeraX-Dicom: 1.2.7
ChimeraX-DistMonitor: 1.4.2
ChimeraX-DockPrep: 1.1.4
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: 1.4.1
ChimeraX-Hbonds: 2.5.3
ChimeraX-Help: 1.3
ChimeraX-HKCage: 1.3
ChimeraX-IHM: 1.1
ChimeraX-ImageFormats: 1.2
ChimeraX-IMOD: 1.0
ChimeraX-IO: 1.0.4
ChimeraX-ItemsInspection: 1.0.1
ChimeraX-IUPAC: 1.0
ChimeraX-KVFinder: 1.7.3
ChimeraX-Label: 1.2
ChimeraX-ListInfo: 1.2.2
ChimeraX-Log: 1.2.2
ChimeraX-LookingGlass: 1.1
ChimeraX-Maestro: 1.9.2
ChimeraX-Map: 1.3
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: 2.2.2
ChimeraX-MCopy: 1.0
ChimeraX-MCPServer: 0.1.0
ChimeraX-MDcrds: 2.17.2
ChimeraX-MedicalToolbar: 1.1
ChimeraX-Meeting: 1.0.1
ChimeraX-Minimize: 1.3.2
ChimeraX-MLP: 1.1.1
ChimeraX-mmCIF: 2.16
ChimeraX-MMTF: 2.2
ChimeraX-ModelArchive: 1.0
ChimeraX-Modeller: 1.5.22
ChimeraX-ModelPanel: 1.6
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: 1.0.1
ChimeraX-MutationScores: 1.0
ChimeraX-Neuron: 1.0
ChimeraX-Nifti: 1.2
ChimeraX-NMRSTAR: 1.0.2
ChimeraX-NRRD: 1.2
ChimeraX-Nucleotides: 2.0.3
ChimeraX-OpenCommand: 1.15.2
ChimeraX-OrthoPick: 1.0.1
ChimeraX-PDB: 2.7.11
ChimeraX-PDBBio: 1.0.1
ChimeraX-PDBLibrary: 1.0.5
ChimeraX-PDBMatrices: 1.0
ChimeraX-PickBlobs: 1.0.1
ChimeraX-Positions: 1.0
ChimeraX-PresetMgr: 1.1.4
ChimeraX-ProfileGrids: 1.4.2
ChimeraX-PubChem: 2.2
ChimeraX-ReadPbonds: 1.0.1
ChimeraX-Registration: 1.1.2
ChimeraX-RemoteControl: 1.0
ChimeraX-RenderByAttr: 1.6.5
ChimeraX-RenumberResidues: 1.1
ChimeraX-ResidueFit: 1.0.1
ChimeraX-RestServer: 1.3.3
ChimeraX-RNALayout: 1.0
ChimeraX-RotamerLibMgr: 4.0
ChimeraX-RotamerLibsDunbrack: 2.0
ChimeraX-RotamerLibsDynameomics: 2.0
ChimeraX-RotamerLibsRichardson: 2.0
ChimeraX-SaveCommand: 1.5.2
ChimeraX-Scenes: 0.3.1
ChimeraX-SchemeMgr: 1.0
ChimeraX-SDF: 2.0.3
ChimeraX-Segger: 1.0
ChimeraX-Segment: 1.0.1
ChimeraX-Segmentations: 3.5.10
ChimeraX-SelInspector: 1.0
ChimeraX-SeqView: 2.17.3
ChimeraX-Shape: 1.1
ChimeraX-Shell: 1.0.1
ChimeraX-Shortcuts: 1.2.1
ChimeraX-ShowSequences: 1.0.3
ChimeraX-SideView: 1.0.1
ChimeraX-SimilarStructures: 1.0.1
ChimeraX-Smiles: 2.1.2
ChimeraX-SmoothLines: 1.0
ChimeraX-SpaceNavigator: 1.0
ChimeraX-StdCommands: 1.19.1
ChimeraX-STL: 1.0.1
ChimeraX-Storm: 1.0
ChimeraX-StructMeasure: 1.2.1
ChimeraX-Struts: 1.0.1
ChimeraX-Surface: 1.0.1
ChimeraX-SwapAA: 2.0.1
ChimeraX-SwapRes: 2.5.2
ChimeraX-TapeMeasure: 1.0
ChimeraX-TaskManager: 1.0
ChimeraX-Test: 1.0
ChimeraX-Toolbar: 1.2.3
ChimeraX-ToolshedUtils: 1.2.4
ChimeraX-Topography: 1.0
ChimeraX-ToQuest: 1.0
ChimeraX-Tug: 1.0.1
ChimeraX-UI: 1.49.1
ChimeraX-Umap: 1.0
ChimeraX-uniprot: 2.3.2
ChimeraX-UnitCell: 1.0.1
ChimeraX-ViewDock: 1.5.2
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: 1.1.5
ChimeraX-Zone: 1.0.1
click: 8.3.1
colorama: 0.4.6
comm: 0.2.3
contourpy: 1.3.3
coverage: 7.13.0
cxservices: 1.2.3
cycler: 0.12.1
Cython: 3.1.4
debugpy: 1.8.19
decorator: 5.2.1
docutils: 0.21.2
executing: 2.2.1
filelock: 3.19.1
fonttools: 4.61.1
frozenlist: 1.8.0
funcparserlib: 2.0.0a0
glfw: 2.10.0
grako: 3.16.5
h11: 0.16.0
h5py: 3.15.1
html2text: 2025.4.15
httpcore: 1.0.9
httpx: 0.28.1
httpx-sse: 0.4.3
idna: 3.11
ihm: 2.2
imagecodecs: 2024.6.1
imagesize: 1.4.1
iniconfig: 2.3.0
ipykernel: 6.30.1
ipython: 9.5.0
ipython_pygments_lexers: 1.1.1
ipywidgets: 8.1.8
jedi: 0.19.2
Jinja2: 3.1.6
jsonschema: 4.25.1
jsonschema-specifications: 2025.9.1
jupyter_client: 8.6.3
jupyter_core: 5.9.1
jupyterlab_widgets: 3.0.16
kiwisolver: 1.4.9
line_profiler: 5.0.0
lxml: 6.0.2
lz4: 4.3.2
Markdown: 3.8.2
MarkupSafe: 3.0.3
matplotlib: 3.10.7
matplotlib-inline: 0.2.1
mcp: 1.18.0
msgpack: 1.1.1
multidict: 6.7.0
ndindex: 1.10.1
nest-asyncio: 1.6.0
netCDF4: 1.6.5
networkx: 3.3
nibabel: 5.2.0
nptyping: 2.5.0
numexpr: 2.14.1
numpy: 1.26.4
OpenMM: 8.2.0
openvr: 1.26.701
packaging: 25.0
ParmEd: 4.2.2
parso: 0.8.5
pep517: 0.13.1
pexpect: 4.9.0
pickleshare: 0.7.5
pillow: 11.3.0
pip: 25.2
pkginfo: 1.12.1.2
platformdirs: 4.5.1
pluggy: 1.6.0
prompt_toolkit: 3.0.52
propcache: 0.4.1
psutil: 7.0.0
ptyprocess: 0.7.0
pure_eval: 0.2.3
py-cpuinfo: 9.0.0
pybind11: 3.0.1
pycollada: 0.8
pydantic: 2.12.5
pydantic-settings: 2.12.0
pydantic_core: 2.41.5
pydicom: 2.4.4
Pygments: 2.18.0
pynmrstar: 3.3.6
pynrrd: 1.0.0
PyOpenGL: 3.1.10
PyOpenGL-accelerate: 3.1.10
pyopenxr: 1.1.4501
pyparsing: 3.2.5
pyproject_hooks: 1.2.0
PyQt6-commercial: 6.9.1
PyQt6-Qt6: 6.9.2
PyQt6-WebEngine-commercial: 6.9.0
PyQt6-WebEngine-Qt6: 6.9.2
PyQt6_sip: 13.10.2
pytest: 9.0.2
pytest-cov: 7.0.0
python-dateutil: 2.9.0.post0
python-dotenv: 1.2.1
python-multipart: 0.0.21
pytz: 2025.2
pyzmq: 27.1.0
qtconsole: 5.7.0
QtPy: 2.4.3
qtshim: 1.2
RandomWords: 0.4.0
referencing: 0.37.0
requests: 2.32.5
roman-numerals: 4.0.0
roman-numerals-py: 4.0.0
rpds-py: 0.30.0
scipy: 1.14.0
setuptools: 80.9.0
sfftk-rw: 0.8.1
six: 1.17.0
snowballstemmer: 3.0.1
sortedcontainers: 2.4.0
soupsieve: 2.8
Sphinx: 8.2.3
sphinx-autodoc-typehints: 3.2.0
sphinxcontrib-applehelp: 2.0.0
sphinxcontrib-blockdiag: 3.0.0
sphinxcontrib-devhelp: 2.0.0
sphinxcontrib-htmlhelp: 2.1.0
sphinxcontrib-jsmath: 1.0.1
sphinxcontrib-qthelp: 2.0.0
sphinxcontrib-serializinghtml: 2.0.0
sse-starlette: 3.0.4
stack-data: 0.6.3
starlette: 0.50.0
superqt: 0.7.6
tables: 3.10.2
tcia_utils: 1.5.1
tifffile: 2025.3.13
tinyarray: 1.2.5
tornado: 6.5.4
traitlets: 5.14.3
typing-inspection: 0.4.2
typing_extensions: 4.15.0
tzdata: 2025.3
urllib3: 2.6.2
uvicorn: 0.38.0
wcwidth: 0.2.14
webcolors: 24.11.1
wheel: 0.45.1
wheel-filename: 1.4.2
widgetsnbextension: 4.0.15
yarl: 1.22.0
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Query Language
query: TracLinks and the [[TicketQuery]] macro both use a mini “query language” for specifying query filters. Basically, the filters are separated by ampersands (&). Each filter then consists of the ticket field name, an operator, and one or more values. More than one value are separated by a pipe (|), meaning that the filter matches any of the values. To include a literal & or | in a value, escape the character with a backslash (\).
The available operators are:
= | the field content exactly matches one of the values |
~= | the field content contains one or more of the values |
^= | the field content starts with one of the values |
$= | the field content ends with one of the values |
All of these operators can also be negated:
!= | the field content matches none of the values |
!~= | the field content does not contain any of the values |
!^= | the field content does not start with any of the values |
!$= | the field content does not end with any of the values |
The date fields created and modified can be constrained by using the = operator and specifying a value containing two dates separated by two dots (..). Either end of the date range can be left empty, meaning that the corresponding end of the range is open. The date parser understands a few natural date specifications like "3 weeks ago", "last month" and "now", as well as Bugzilla-style date specifications like "1d", "2w", "3m" or "4y" for 1 day, 2 weeks, 3 months and 4 years, respectively. Spaces in date specifications can be left out to avoid having to quote the query string.
created=2007-01-01..2008-01-01 | query tickets created in 2007 |
created=lastmonth..thismonth | query tickets created during the previous month |
modified=1weekago.. | query tickets that have been modified in the last week |
modified=..30daysago | query tickets that have been inactive for the last 30 days |
See also: TracTickets, TracReports, TracGuide