The following bug report has been submitted:
Platform: Windows-10-10.0.19044
ChimeraX Version: 1.5.dev202209270114 (2022-09-27 01:14:36 UTC)
Description
(Describe the actions that caused this problem to occur here)
Log:
UCSF ChimeraX version: 1.5.dev202209270114 (2022-09-27)
© 2016-2022 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
QOpenGLShader::compile(Fragment): ERROR: 4:1: 'textureSampler' : syntax error
syntax error
*** Problematic Fragment shader source code ***
#version 110
#ifdef GL_KHR_blend_equation_advanced
#extension GL_ARB_fragment_coord_conventions : enable
#extension GL_KHR_blend_equation_advanced : enable
#endif
#define lowp
#define mediump
#define highp
#line 1
varying highp vec2 uv;uniform sampler2DRect textureSampler;uniform bool
swizzle;uniform highp float opacity;void main() { highp vec4 tmpFragColor =
texture2DRect(textureSampler,uv); tmpFragColor.a *= opacity; gl_FragColor =
swizzle ? tmpFragColor.bgra : tmpFragColor;}
***
> open "C:\Users\Feixia\Feixia2022\Teaching\BMCB 794\Structure\2H59 clean.pdb"
> format pdb
Chain information for 2H59 clean.pdb #1
---
Chain | Description
A | No description available
D | No description available
> open "C:/Users/Feixia/Feixia2022/Teaching/BMCB 794/Structure/2h4f.pdb"
2h4f.pdb title:
SIR2-P53 peptide-nad+ [more info...]
Chain information for 2h4f.pdb #2
---
Chain | Description | UniProt
A | regulatory protein SIR2 homolog | NPD_THEMA
D | cellular tumor antigen P53 | P53_HUMAN
Non-standard residues in 2h4f.pdb #2
---
NAD — nicotinamide-adenine-dinucleotide
ZN — zinc ion
> matchmaker #2 to #1
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 2H59 clean.pdb, chain A (#1) with 2h4f.pdb, chain A (#2), sequence
alignment score = 1169.7
RMSD between 232 pruned atom pairs is 0.699 angstroms; (across all 240 pairs:
1.150)
> morph #1,2 frames 40
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 111, in segment_and_pair_atoms
results = segmentHingeExact(sm, m, cf, mhs, log=log)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\segment.py", line 109, in segmentHingeExact
raise AtomPairingError('%s chain %s (%d) and %s chain %s (%d) have different
number of residues'
chimerax.morph.segment.AtomPairingError: Morph - 2H59 clean.pdb chain A (352)
and 2h4f.pdb chain A (309) have different number of residues
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\morph.py", line 73, in morph
traj = compute_morph(structures, session.logger, method=method, rate=rate,
frames=frames,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 24, in compute_morph
res_groups, atom_map, trimmed = motion.segment_and_pair_atoms(mol)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 114, in segment_and_pair_atoms
results = segmentHingeApproximate(sm, m, cf, mhs, log=log)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\segment.py", line 190, in segmentHingeApproximate
score, gapped0, gapped1 = align(session, seq0, seq1,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\match_maker\match.py", line 181, in align
for s, ss_info in dssp_cache.items():
AttributeError: 'set' object has no attribute 'items'
AttributeError: 'set' object has no attribute 'items'
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\match_maker\match.py", line 181, in align
for s, ss_info in dssp_cache.items():
See log for complete Python traceback.
> close session
> open "C:/Users/Feixia/Feixia2022/Teaching/BMCB 794/Structure/2KDM-clean.pdb"
> "C:/Users/Feixia/Feixia2022/Teaching/BMCB 794/Structure/2KDL-clean.pdb"
Chain information for 2KDM-clean.pdb #1
---
Chain | Description
A | No description available
Chain information for 2KDL-clean.pdb #2
---
Chain | Description
A | No description available
> matchmaker #2 to #1
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 2KDM-clean.pdb, chain A (#1) with 2KDL-clean.pdb, chain A (#2),
sequence alignment score = 115.3
RMSD between 5 pruned atom pairs is 1.065 angstroms; (across all 56 pairs:
15.446)
> morph #1,2
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 111, in segment_and_pair_atoms
results = segmentHingeExact(sm, m, cf, mhs, log=log)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\segment.py", line 116, in segmentHingeExact
raise AtomPairingError("residues have different number atoms")
chimerax.morph.segment.AtomPairingError: residues have different number atoms
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\morph.py", line 73, in morph
traj = compute_morph(structures, session.logger, method=method, rate=rate,
frames=frames,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 24, in compute_morph
res_groups, atom_map, trimmed = motion.segment_and_pair_atoms(mol)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 114, in segment_and_pair_atoms
results = segmentHingeApproximate(sm, m, cf, mhs, log=log)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\segment.py", line 190, in segmentHingeApproximate
score, gapped0, gapped1 = align(session, seq0, seq1,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\match_maker\match.py", line 181, in align
for s, ss_info in dssp_cache.items():
AttributeError: 'set' object has no attribute 'items'
AttributeError: 'set' object has no attribute 'items'
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\match_maker\match.py", line 181, in align
for s, ss_info in dssp_cache.items():
See log for complete Python traceback.
> morph #1,2
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 111, in segment_and_pair_atoms
results = segmentHingeExact(sm, m, cf, mhs, log=log)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\segment.py", line 116, in segmentHingeExact
raise AtomPairingError("residues have different number atoms")
chimerax.morph.segment.AtomPairingError: residues have different number atoms
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\morph.py", line 73, in morph
traj = compute_morph(structures, session.logger, method=method, rate=rate,
frames=frames,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 24, in compute_morph
res_groups, atom_map, trimmed = motion.segment_and_pair_atoms(mol)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 114, in segment_and_pair_atoms
results = segmentHingeApproximate(sm, m, cf, mhs, log=log)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\segment.py", line 190, in segmentHingeApproximate
score, gapped0, gapped1 = align(session, seq0, seq1,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\match_maker\match.py", line 181, in align
for s, ss_info in dssp_cache.items():
AttributeError: 'set' object has no attribute 'items'
AttributeError: 'set' object has no attribute 'items'
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\match_maker\match.py", line 181, in align
for s, ss_info in dssp_cache.items():
See log for complete Python traceback.
> open 3gbp
Summary of feedback from opening 3gbp fetched from pdb
---
notes | Fetching compressed mmCIF 3gbp from
http://files.rcsb.org/download/3gbp.cif
Fetching CCD BGC from http://ligand-expo.rcsb.org/reports/B/BGC/BGC.cif
3gbp title:
Structure of the periplasmic glucose/galactose receptor of salmonella
typhimurium [more info...]
Chain information for 3gbp #3
---
Chain | Description | UniProt
A | GALACTOSE-BINDING PROTEIN | DGAL_SALTY
Non-standard residues in 3gbp #3
---
BGC — beta-D-glucopyranose
CA — calcium ion
> close session
> open 3gbp
3gbp title:
Structure of the periplasmic glucose/galactose receptor of salmonella
typhimurium [more info...]
Chain information for 3gbp #1
---
Chain | Description | UniProt
A | GALACTOSE-BINDING PROTEIN | DGAL_SALTY
Non-standard residues in 3gbp #1
---
BGC — beta-D-glucopyranose
CA — calcium ion
> open 2fwo
Summary of feedback from opening 2fwo fetched from pdb
---
note | Fetching compressed mmCIF 2fwo from
http://files.rcsb.org/download/2fwo.cif
2fwo title:
MHC Class I H-2Kd heavy chain in complex with beta-2microglobulin and peptide
derived from influenza nucleoprotein [more info...]
Chain information for 2fwo #2
---
Chain | Description | UniProt
A | H-2 class I histocompatibility antigen, K-D alpha chain | HA1D_MOUSE
B | Beta-2-microglobulin | B2MG_MOUSE
P | TYQRTRALV peptide from Nucleoprotein | Q701N7_9INFA
> matchmaker #2 to #1
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 3gbp, chain A (#1) with 2fwo, chain P (#2), sequence alignment
score = 9.4
RMSD between 6 pruned atom pairs is 1.219 angstroms; (across all 9 pairs:
7.101)
> close session
> open 2fw0
Summary of feedback from opening 2fw0 fetched from pdb
---
notes | Fetching compressed mmCIF 2fw0 from
http://files.rcsb.org/download/2fw0.cif
Fetching CCD NA from http://ligand-expo.rcsb.org/reports/N/NA/NA.cif
Fetching CCD CIT from http://ligand-expo.rcsb.org/reports/C/CIT/CIT.cif
Fetching CCD MLA from http://ligand-expo.rcsb.org/reports/M/MLA/MLA.cif
2fw0 title:
Apo Open Form of Glucose/Galactose Binding Protein [more info...]
Chain information for 2fw0 #1
---
Chain | Description | UniProt
A | D-galactose-binding periplasmic protein | DGAL_ECOLI
Non-standard residues in 2fw0 #1
---
CA — calcium ion
CIT — citric acid
MLA — malonic acid (dicarboxylic acid C3; propanediolic acid;
methanedicarboxylic acid)
NA — sodium ion
> save "C:/Users/Feixia/Feixia2022/Teaching/BMCB 794/Structure/2fw0.pdb"
> relModel #1
> open 3gbp
3gbp title:
Structure of the periplasmic glucose/galactose receptor of salmonella
typhimurium [more info...]
Chain information for 3gbp #2
---
Chain | Description | UniProt
A | GALACTOSE-BINDING PROTEIN | DGAL_SALTY
Non-standard residues in 3gbp #2
---
BGC — beta-D-glucopyranose
CA — calcium ion
> matchmaker #2 to #1
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 2fw0, chain A (#1) with 3gbp, chain A (#2), sequence alignment
score = 1483.7
RMSD between 150 pruned atom pairs is 0.439 angstroms; (across all 304 pairs:
6.811)
> ui tool show "Color Actions"
> set bgColor white
> preset "overall look" "publication 1 (silhouettes)"
Using preset: Overall Look / Publication 1 (Silhouettes)
Preset expands to these ChimeraX commands:
set bg white
graphics silhouettes t
lighting depthCue f
> morph #1,2
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 111, in segment_and_pair_atoms
results = segmentHingeExact(sm, m, cf, mhs, log=log)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\segment.py", line 109, in segmentHingeExact
raise AtomPairingError('%s chain %s (%d) and %s chain %s (%d) have different
number of residues'
chimerax.morph.segment.AtomPairingError: Morph - 2fw0 chain A (661) and 3gbp
chain A (413) have different number of residues
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\morph.py", line 73, in morph
traj = compute_morph(structures, session.logger, method=method, rate=rate,
frames=frames,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 24, in compute_morph
res_groups, atom_map, trimmed = motion.segment_and_pair_atoms(mol)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 114, in segment_and_pair_atoms
results = segmentHingeApproximate(sm, m, cf, mhs, log=log)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\segment.py", line 190, in segmentHingeApproximate
score, gapped0, gapped1 = align(session, seq0, seq1,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\match_maker\match.py", line 181, in align
for s, ss_info in dssp_cache.items():
AttributeError: 'set' object has no attribute 'items'
AttributeError: 'set' object has no attribute 'items'
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\match_maker\match.py", line 181, in align
for s, ss_info in dssp_cache.items():
See log for complete Python traceback.
> matchmaker #2 to #1
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 2fw0, chain A (#1) with 3gbp, chain A (#2), sequence alignment
score = 1483.7
RMSD between 150 pruned atom pairs is 0.439 angstroms; (across all 304 pairs:
6.811)
> close session
> open "C:\Users\Feixia\Feixia2022\Teaching\BMCB 794\Structure\2H59 clean.pdb"
> format pdb
Chain information for 2H59 clean.pdb #1
---
Chain | Description
A | No description available
D | No description available
> ui tool show "Color Actions"
> set bgColor white
> select clear
> open "C:/Users/Feixia/Feixia2022/Teaching/BMCB 794/Structure/2h4f.pdb"
2h4f.pdb title:
SIR2-P53 peptide-nad+ [more info...]
Chain information for 2h4f.pdb #2
---
Chain | Description | UniProt
A | regulatory protein SIR2 homolog | NPD_THEMA
D | cellular tumor antigen P53 | P53_HUMAN
Non-standard residues in 2h4f.pdb #2
---
NAD — nicotinamide-adenine-dinucleotide
ZN — zinc ion
> matchmaker #2 to #1
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 2H59 clean.pdb, chain A (#1) with 2h4f.pdb, chain A (#2), sequence
alignment score = 1169.7
RMSD between 232 pruned atom pairs is 0.699 angstroms; (across all 240 pairs:
1.150)
> preset "overall look" "publication 1 (silhouettes)"
Using preset: Overall Look / Publication 1 (Silhouettes)
Preset expands to these ChimeraX commands:
set bg white
graphics silhouettes t
lighting depthCue f
> morph #1,2
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 111, in segment_and_pair_atoms
results = segmentHingeExact(sm, m, cf, mhs, log=log)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\segment.py", line 109, in segmentHingeExact
raise AtomPairingError('%s chain %s (%d) and %s chain %s (%d) have different
number of residues'
chimerax.morph.segment.AtomPairingError: Morph - 2H59 clean.pdb chain A (352)
and 2h4f.pdb chain A (309) have different number of residues
During handling of the above exception, another exception occurred:
Traceback (most recent call last):
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\cmd_line\tool.py", line 319, in execute
cmd.run(cmd_text)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\core\commands\cli.py", line 2897, in run
result = ci.function(session, **kw_args)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\morph.py", line 73, in morph
traj = compute_morph(structures, session.logger, method=method, rate=rate,
frames=frames,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 24, in compute_morph
res_groups, atom_map, trimmed = motion.segment_and_pair_atoms(mol)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\motion.py", line 114, in segment_and_pair_atoms
results = segmentHingeApproximate(sm, m, cf, mhs, log=log)
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\morph\segment.py", line 190, in segmentHingeApproximate
score, gapped0, gapped1 = align(session, seq0, seq1,
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\match_maker\match.py", line 181, in align
for s, ss_info in dssp_cache.items():
AttributeError: 'set' object has no attribute 'items'
AttributeError: 'set' object has no attribute 'items'
File "C:\Program Files\ChimeraX\bin\lib\site-
packages\chimerax\match_maker\match.py", line 181, in align
for s, ss_info in dssp_cache.items():
See log for complete Python traceback.
OpenGL version: 3.3.0 - Build 20.19.15.4835
OpenGL renderer: Intel(R) HD Graphics 5500
OpenGL vendor: Intel
Python: 3.9.11
Locale: en_US.cp1252
Qt version: PyQt6 6.3.1, Qt 6.3.1
Qt runtime version: 6.3.2
Qt platform: windows
Manufacturer: LENOVO
Model: 20BXCTO1WW
OS: Microsoft Windows 10 Education (Build 19044)
Memory: 12,566,208,512
MaxProcessMemory: 137,438,953,344
CPU: 4 Intel(R) Core(TM) i7-5600U CPU @ 2.60GHz
OSLanguage: en-US
Installed Packages:
alabaster: 0.7.12
appdirs: 1.4.4
asttokens: 2.0.8
Babel: 2.10.3
backcall: 0.2.0
blockdiag: 3.0.0
build: 0.8.0
certifi: 2022.9.24
cftime: 1.6.2
charset-normalizer: 2.1.1
ChimeraX-AddCharge: 1.4
ChimeraX-AddH: 2.2
ChimeraX-AlignmentAlgorithms: 2.0
ChimeraX-AlignmentHdrs: 3.2.1
ChimeraX-AlignmentMatrices: 2.0
ChimeraX-Alignments: 2.6
ChimeraX-AlphaFold: 1.0
ChimeraX-AltlocExplorer: 1.0.3
ChimeraX-AmberInfo: 1.0
ChimeraX-Arrays: 1.0
ChimeraX-Atomic: 1.41.3
ChimeraX-AtomicLibrary: 8.0.1
ChimeraX-AtomSearch: 2.0.1
ChimeraX-AxesPlanes: 2.3
ChimeraX-BasicActions: 1.1.2
ChimeraX-BILD: 1.0
ChimeraX-BlastProtein: 2.1.2
ChimeraX-BondRot: 2.0.1
ChimeraX-BugReporter: 1.0.1
ChimeraX-BuildStructure: 2.7.1
ChimeraX-Bumps: 1.0
ChimeraX-BundleBuilder: 1.2
ChimeraX-ButtonPanel: 1.0.1
ChimeraX-CageBuilder: 1.0.1
ChimeraX-CellPack: 1.0
ChimeraX-Centroids: 1.3.1
ChimeraX-ChangeChains: 1.0.2
ChimeraX-CheckWaters: 1.3
ChimeraX-ChemGroup: 2.0
ChimeraX-Clashes: 2.2.4
ChimeraX-ColorActions: 1.0.2
ChimeraX-ColorGlobe: 1.0
ChimeraX-ColorKey: 1.5.2
ChimeraX-CommandLine: 1.2.4
ChimeraX-ConnectStructure: 2.0.1
ChimeraX-Contacts: 1.0.1
ChimeraX-Core: 1.5.dev202209270114
ChimeraX-CoreFormats: 1.1
ChimeraX-coulombic: 1.3.2
ChimeraX-Crosslinks: 1.0
ChimeraX-Crystal: 1.0
ChimeraX-CrystalContacts: 1.0.1
ChimeraX-DataFormats: 1.2.2
ChimeraX-Dicom: 1.1
ChimeraX-DistMonitor: 1.3
ChimeraX-DockPrep: 1.0
ChimeraX-Dssp: 2.0
ChimeraX-EMDB-SFF: 1.0
ChimeraX-ExperimentalCommands: 1.0
ChimeraX-FileHistory: 1.0.1
ChimeraX-FunctionKey: 1.0.1
ChimeraX-Geometry: 1.2
ChimeraX-gltf: 1.0
ChimeraX-Graphics: 1.1
ChimeraX-Hbonds: 2.4
ChimeraX-Help: 1.2.1
ChimeraX-HKCage: 1.3
ChimeraX-IHM: 1.1
ChimeraX-ImageFormats: 1.2
ChimeraX-IMOD: 1.0
ChimeraX-IO: 1.0.1
ChimeraX-ItemsInspection: 1.0.1
ChimeraX-Label: 1.1.7
ChimeraX-ListInfo: 1.1.1
ChimeraX-Log: 1.1.5
ChimeraX-LookingGlass: 1.1
ChimeraX-Maestro: 1.8.1
ChimeraX-Map: 1.1.1
ChimeraX-MapData: 2.0
ChimeraX-MapEraser: 1.0.1
ChimeraX-MapFilter: 2.0
ChimeraX-MapFit: 2.0
ChimeraX-MapSeries: 2.1.1
ChimeraX-Markers: 1.0.1
ChimeraX-Mask: 1.0.1
ChimeraX-MatchMaker: 2.0.9
ChimeraX-MDcrds: 2.6
ChimeraX-MedicalToolbar: 1.0.2
ChimeraX-Meeting: 1.0.1
ChimeraX-MLP: 1.1
ChimeraX-mmCIF: 2.8
ChimeraX-MMTF: 2.1
ChimeraX-Modeller: 1.5.6
ChimeraX-ModelPanel: 1.3.6
ChimeraX-ModelSeries: 1.0.1
ChimeraX-Mol2: 2.0
ChimeraX-Mole: 1.0
ChimeraX-Morph: 1.0
ChimeraX-MouseModes: 1.1.1
ChimeraX-Movie: 1.0
ChimeraX-Neuron: 1.0
ChimeraX-Nucleotides: 2.0.3
ChimeraX-OpenCommand: 1.9.1
ChimeraX-PDB: 2.6.7
ChimeraX-PDBBio: 1.0
ChimeraX-PDBLibrary: 1.0.2
ChimeraX-PDBMatrices: 1.0
ChimeraX-PickBlobs: 1.0.1
ChimeraX-Positions: 1.0
ChimeraX-PresetMgr: 1.1
ChimeraX-PubChem: 2.1
ChimeraX-ReadPbonds: 1.0.1
ChimeraX-Registration: 1.1.1
ChimeraX-RemoteControl: 1.0
ChimeraX-RenumberResidues: 1.1
ChimeraX-ResidueFit: 1.0.1
ChimeraX-RestServer: 1.1
ChimeraX-RNALayout: 1.0
ChimeraX-RotamerLibMgr: 2.0.1
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
ChimeraX-Segger: 1.0
ChimeraX-Segment: 1.0
ChimeraX-SelInspector: 1.0
ChimeraX-SeqView: 2.7.2
ChimeraX-Shape: 1.0.1
ChimeraX-Shell: 1.0.1
ChimeraX-Shortcuts: 1.1.1
ChimeraX-ShowSequences: 1.0.1
ChimeraX-SideView: 1.0.1
ChimeraX-Smiles: 2.1
ChimeraX-SmoothLines: 1.0
ChimeraX-SpaceNavigator: 1.0
ChimeraX-StdCommands: 1.10
ChimeraX-STL: 1.0
ChimeraX-Storm: 1.0
ChimeraX-StructMeasure: 1.1
ChimeraX-Struts: 1.0.1
ChimeraX-Surface: 1.0
ChimeraX-SwapAA: 2.0.1
ChimeraX-SwapRes: 2.1.3
ChimeraX-TapeMeasure: 1.0
ChimeraX-Test: 1.0
ChimeraX-Toolbar: 1.1.2
ChimeraX-ToolshedUtils: 1.2.1
ChimeraX-Tug: 1.0.1
ChimeraX-UI: 1.24.1
ChimeraX-uniprot: 2.2.1
ChimeraX-UnitCell: 1.0.1
ChimeraX-ViewDockX: 1.1.3
ChimeraX-VIPERdb: 1.0
ChimeraX-Vive: 1.1
ChimeraX-VolumeMenu: 1.0.1
ChimeraX-VTK: 1.0
ChimeraX-WavefrontOBJ: 1.0
ChimeraX-WebCam: 1.0.1
ChimeraX-WebServices: 1.1.0
ChimeraX-Zone: 1.0.1
colorama: 0.4.5
comtypes: 1.1.10
cxservices: 1.2
cycler: 0.11.0
Cython: 0.29.32
debugpy: 1.6.3
decorator: 5.1.1
docutils: 0.19
entrypoints: 0.4
executing: 1.1.0
filelock: 3.7.1
fonttools: 4.37.3
funcparserlib: 1.0.0
grako: 3.16.5
h5py: 3.7.0
html2text: 2020.1.16
idna: 3.4
ihm: 0.33
imagecodecs: 2022.7.31
imagesize: 1.4.1
importlib-metadata: 4.12.0
ipykernel: 6.15.3
ipython: 8.4.0
ipython-genutils: 0.2.0
jedi: 0.18.1
Jinja2: 3.1.2
jupyter-client: 7.3.4
jupyter-core: 4.11.1
kiwisolver: 1.4.4
line-profiler: 3.5.1
lxml: 4.9.1
lz4: 4.0.2
MarkupSafe: 2.1.1
matplotlib: 3.5.2
matplotlib-inline: 0.1.6
msgpack: 1.0.4
nest-asyncio: 1.5.5
netCDF4: 1.6.0
networkx: 2.8.5
numexpr: 2.8.3
numpy: 1.23.1
openvr: 1.23.701
packaging: 21.3
ParmEd: 3.4.3
parso: 0.8.3
pep517: 0.13.0
pickleshare: 0.7.5
Pillow: 9.2.0
pip: 22.2.2
pkginfo: 1.8.3
prompt-toolkit: 3.0.31
psutil: 5.9.1
pure-eval: 0.2.2
pycollada: 0.7.2
pydicom: 2.3.0
Pygments: 2.12.0
PyOpenGL: 3.1.5
PyOpenGL-accelerate: 3.1.5
pyparsing: 3.0.9
PyQt6-commercial: 6.3.1
PyQt6-Qt6: 6.3.2
PyQt6-sip: 13.4.0
PyQt6-WebEngine-commercial: 6.3.1
PyQt6-WebEngine-Qt6: 6.3.2
python-dateutil: 2.8.2
pytz: 2022.2.1
pywin32: 303
pyzmq: 24.0.1
qtconsole: 5.3.1
QtPy: 2.2.0
RandomWords: 0.4.0
requests: 2.28.1
scipy: 1.9.0
setuptools: 65.1.1
sfftk-rw: 0.7.2
six: 1.16.0
snowballstemmer: 2.2.0
sortedcontainers: 2.4.0
Sphinx: 5.1.1
sphinx-autodoc-typehints: 1.19.1
sphinxcontrib-applehelp: 1.0.2
sphinxcontrib-blockdiag: 3.0.0
sphinxcontrib-devhelp: 1.0.2
sphinxcontrib-htmlhelp: 2.0.0
sphinxcontrib-jsmath: 1.0.1
sphinxcontrib-qthelp: 1.0.3
sphinxcontrib-serializinghtml: 1.1.5
stack-data: 0.5.1
tables: 3.7.0
tifffile: 2022.7.31
tinyarray: 1.2.4
tomli: 2.0.1
tornado: 6.2
traitlets: 5.3.0
urllib3: 1.26.12
wcwidth: 0.2.5
webcolors: 1.12
wheel: 0.37.1
wheel-filename: 1.4.1
WMI: 1.5.1
zipp: 3.8.1
Hi Feixia,
--Eric