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rs-station
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laue-dials
A package for analyzing Laue x-ray crystallography data using the DIALS framework.
https://rs-station.github.io/laue-dials/
MIT License
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laue.integrate takes longer with increasing nproc
#62
toastisme
opened
1 month ago
1
laue.sequence_to_stills crashes when using slice of data that does not start at image 0
#61
toastisme
opened
1 month ago
0
Profile fitting does not include 0-intensity pixels
#60
PrinceWalnut
opened
2 months ago
0
Enforcing Unit Cell during laue.optimize_indexing can have bad orientation
#59
PrinceWalnut
opened
4 months ago
0
Workflow for testing against non-main DIALS branches
#58
PrinceWalnut
opened
5 months ago
0
[pre-commit.ci] pre-commit autoupdate
#57
pre-commit-ci[bot]
closed
2 weeks ago
1
laue.compute_rmsds y-axis should start at 0
#56
PrinceWalnut
closed
6 months ago
3
laue.refine should not output a beam with a random wavelength
#55
PrinceWalnut
opened
7 months ago
0
account for multiplicity in spot prediction/res-dep BW
#54
DHekstra
opened
7 months ago
2
print out all rmsds
#53
hkwang
closed
7 months ago
3
Docs for laue.optimize_indexing unclear around d_min
#52
PrinceWalnut
opened
7 months ago
0
[pre-commit.ci] pre-commit autoupdate
#51
pre-commit-ci[bot]
closed
6 months ago
1
show the user how to set the unit cell dims in the final MTZ
#50
DHekstra
closed
8 months ago
2
laue.sequence_to_stills from laue-dials 0.3 leads to spot predictions with high RMSDs
#49
hkwang
opened
8 months ago
2
laue.optimize indexing should have sequential mode
#48
PrinceWalnut
opened
9 months ago
1
laue.refine should have aggregate statistics printed
#47
PrinceWalnut
opened
9 months ago
0
laue.version command
#46
PrinceWalnut
opened
9 months ago
0
Requested functionality for unit-cell/wavelength conversion
#45
PrinceWalnut
opened
9 months ago
4
laue.predict KDE probabilities slow
#44
PrinceWalnut
opened
9 months ago
0
IOCTL error in jupyter notebook
#43
DHekstra
closed
9 months ago
1
doc error?
#42
DHekstra
closed
9 months ago
3
nproc issue?
#41
DHekstra
closed
9 months ago
2
HKLs of (000) with nonzero wavelengths discovered after refinement
#40
PrinceWalnut
closed
9 months ago
1
n_proc and nproc for different commands should all be nproc
#39
PrinceWalnut
closed
9 months ago
1
the documentation badge does not link to the documentation
#38
kmdalton
closed
9 months ago
1
Log files should include a version number
#37
PrinceWalnut
closed
9 months ago
1
Minor docs update
#36
dennisbrookner
opened
9 months ago
2
fast-forward docupdate branch
#35
dennisbrookner
closed
9 months ago
0
sequence_to_stills output parameters unsuccessful in renaming experiment & reflection files
#34
maggie-klureza
closed
9 months ago
1
laue_dials.find_spots log does not contain meaningful information
#33
maggie-klureza
closed
9 months ago
8
Decoy parameters for laue_dials.find_spots, potentially other functions.
#32
maggie-klureza
closed
9 months ago
3
issue with multiprocessing during spot finding
#31
DHekstra
closed
9 months ago
2
[pre-commit.ci] pre-commit autoupdate
#30
pre-commit-ci[bot]
closed
9 months ago
1
add new CLI and instructions for dev install
#29
dennisbrookner
closed
10 months ago
0
Issues with reading in multiple passes
#28
DHekstra
opened
11 months ago
8
[pre-commit.ci] pre-commit autoupdate
#27
pre-commit-ci[bot]
closed
10 months ago
1
Online documentation of command-line functions
#26
dennisbrookner
closed
11 months ago
4
[pre-commit.ci] pre-commit autoupdate
#25
pre-commit-ci[bot]
closed
11 months ago
1
SVG failed to converge in laue.integrate
#24
PrinceWalnut
closed
10 months ago
1
Unit test coverage
#23
PrinceWalnut
opened
1 year ago
0
PinkIndexer Option
#22
PrinceWalnut
opened
1 year ago
0
Laue refiner
#21
PrinceWalnut
opened
1 year ago
0
Python-level parallelism
#20
PrinceWalnut
closed
10 months ago
0
Coset prediction would be useful
#19
PrinceWalnut
opened
1 year ago
0
DIALS>=v3.15.0 broken
#18
PrinceWalnut
closed
10 months ago
1
disable format check wherever possible
#17
kmdalton
closed
10 months ago
0
set laue.refine to use SparseLevMar
#16
kmdalton
closed
1 year ago
1
laue.optimize_indexing should guess d_min
#15
kmdalton
opened
1 year ago
0
Clean gen beams
#14
kmdalton
closed
1 year ago
1
check_format False in laue.refine
#13
kmdalton
closed
1 year ago
1
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