Dominik Demuth
09e415babf
begin work on gui
2023-05-23 19:23:13 +02:00
4e2938b2a2
proper handling of sets without label,; closes #73
2023-05-23 06:40:08 +00:00
Dominik Demuth
685b9d2316
HN + Excess wing
2023-05-22 18:50:03 +02:00
Dominik Demuth
b91fbf7621
tg evaluation in dsc
2023-05-22 18:49:49 +02:00
Dominik Demuth
8d55430246
binning added to points
2023-05-22 18:49:27 +02:00
Dominik Demuth
8d06240205
Merge branch 'fit'
2023-05-19 18:14:29 +02:00
Dominik Demuth
65034d4518
sub function show numbering; closes #70
2023-05-19 18:13:57 +02:00
Dominik Demuth
2adf15104f
attempt to only show real/imag part of complex fit functions; closes #72
2023-05-19 17:35:32 +02:00
Dominik Demuth
cd9c85c12b
add FID as fallback option for dtype in nmrreader
2023-05-19 16:56:01 +02:00
Dominik Demuth
84d136dd4c
.nmr files recognize all data types; closes #71
2023-05-19 16:53:54 +02:00
Dominik Demuth
f60e125487
display parameter name with number ind window
2023-05-19 16:41:24 +02:00
Dominik Demuth
1e9a390ae2
attempt to distinguish general and set-specifi parameter
2023-05-19 16:17:49 +02:00
Dominik Demuth
8673e5acdb
catch error in f-test
2023-05-19 16:00:04 +02:00
Dominik Demuth
66a0e40a23
display correct start parameter
2023-05-19 15:48:32 +02:00
Dominik Demuth
a1ab6335c5
remove remnants of fitresult redesign; closes #68
2023-05-19 13:25:56 +02:00
Dominik Demuth
09a2b61160
read text files as BDS and DSC
2023-05-19 13:02:58 +02:00
Dominik Demuth
681b49a22f
Merge branch 'read_fc'
2023-05-19 11:37:42 +02:00
Dominik Demuth
3dcd44c3ee
restore optionality to figure saving
2023-05-19 11:37:24 +02:00
Dominik Demuth
6e9dd4d45f
use gnuplot as lightweight plotter
2023-05-19 11:33:02 +02:00
Dominik Demuth
67d60949b5
plot fit and residual together with bigger fit
2023-05-18 20:43:45 +02:00
Dominik Demuth
fcaf43b3eb
fixed problem with setting color from context menu
2023-05-18 18:51:02 +02:00
Dominik Demuth
49101565a3
fixed problem with setting color from context menu
2023-05-17 19:41:44 +02:00
255d7c7862
Update 'src/nmreval/io/dsc.py'
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remove matplotlib import
2023-05-17 15:39:36 +00:00
Dominik Demuth
12dacb73b3
add QMessageBox to display existing backup files
2023-05-16 20:05:55 +02:00
Dominik Demuth
b127cc15e2
dsc: only use low temperature to baseline correct calibration without enthalpy
2023-05-16 19:22:50 +02:00
Dominik Demuth
bc215ce32b
some stuff done
2023-05-16 17:45:39 +02:00
Dominik Demuth
996b0b2ae2
tnm function with numpy arrays
2023-05-14 20:05:10 +02:00
Dominik Demuth
753cd06dd1
pick position remembers selected destination graph; closes #62
2023-05-14 18:16:23 +02:00
Dominik Demuth
45d319834b
fitresult window is reused and remembers fitplot range/log; closes #65
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add color to sub-functions in fit result window
Fitresult window shows one set at a time, more space for plot; closes #66
2023-05-14 15:24:25 +02:00
Dominik Demuth
11ed3c16eb
add tnmh stuff
2023-05-13 19:23:15 +02:00
Dominik Demuth
edf858da29
hacky solution to have correct tuda colors in agr file; closes #63
2023-05-11 20:12:32 +02:00
Dominik Demuth
e10b85b904
more correct lines preview in asciireader
2023-05-11 18:28:03 +02:00
Dominik Demuth
267554b252
check for empty line moved to avoid error
2023-05-11 18:00:29 +02:00
Dominik Demuth
233cdd9f80
add gnuplot to requirements for plots of FC reading
2023-05-10 17:09:11 +02:00
Dominik Demuth
15c959fd71
save fit parameter adds name to file as extra comment; possible solution for #59
2023-05-08 19:54:55 +02:00
Dominik Demuth
1378cf6ac7
Fitresult accepts label argument as set name
2023-05-08 18:48:08 +02:00
Dominik Demuth
a964e02612
correct baseline and slopes for calibration measurements at high DSC rates
2023-05-08 18:20:04 +02:00
Dominik Demuth
a72e4ba833
add logging to fit exception to retain more info; all references to current graph are either None or id
2023-05-03 19:06:35 +02:00
Dominik Demuth
75ec462efd
add logging to fit exception to retain more info and find problem with #56 ; all references to current graph are either None or id, should close #57
2023-05-03 19:04:25 +02:00
Dominik Demuth
adcd98fc31
dsc baseline uses consistent offset for correction; closes #53
2023-05-02 17:35:28 +02:00
d8cc99cea4
dsc ( #55 )
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closes #53
Co-authored-by: Dominik Demuth <dominik.demuth@physik.tu-darmstadt.de>
Reviewed-on: #55
2023-04-30 18:21:16 +00:00
Dominik Demuth
7671a56b6f
merge cfunc -> main
2023-04-30 14:59:58 +02:00
Dominik Demuth
8086dd5276
finalized c functions
2023-04-29 20:40:32 +02:00
Dominik Demuth
9479364a64
delete item after the iteration to find its index; closes #52
2023-04-27 19:08:14 +02:00
def2a99ed8
datawidget.py: raise AttributeError manually if item is graph, was not always raised; maybe problem of #52
2023-04-27 12:15:43 +02:00
Dominik Demuth
ac4a4d3b8e
DSC: remove non-finite values due mismatch in beginnings of sample and empty
2023-04-24 19:24:23 +02:00
Dominik Demuth
dd1c26e285
more work on loggaussian
2023-04-23 19:55:53 +02:00
Dominik Demuth
eba7869c4d
data list in QEvalDialog uses current names instead of stored
2023-04-19 19:43:04 +02:00
Dominik Demuth
efd5b34b13
create .local/bin folder for AppImage if not existent
2023-04-19 18:33:11 +02:00
Dominik Demuth
2d472bd44e
lower epsabs for integration of energy barrier spec dens
2023-04-19 18:24:29 +02:00
Dominik Demuth
2042148d0f
C function for energy distribution spectral density
2023-04-17 20:17:54 +02:00
Dominik Demuth
4a9d50e8a4
refactor Log-Gaussian susceptibility
2023-04-17 17:43:18 +02:00
Dominik Demuth
56b588293d
add loggausian to c func and move lookup of c library
2023-04-17 17:31:34 +02:00
59625c1581
more_bugs ( #51 )
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closes #46 , #47 , #7
Co-authored-by: Dominik Demuth <dominik.demuth@physik.tu-darmstadt.de>
Reviewed-on: #51
2023-04-16 15:40:58 +00:00
Dominik Demuth
bb3d5ac58b
remoce matplotlib import
2023-04-16 14:33:05 +02:00
Dominik Demuth
48861c3f80
remove spurious print
2023-04-16 14:20:40 +02:00
Dominik Demuth
8e2ebfc765
Merge branch 'more_bugs'
2023-04-16 14:17:36 +02:00
Dominik Demuth
924b58beda
move iteration of deleting sets inside undo, fixes #36
2023-04-15 15:49:08 +02:00
Dominik Demuth
bd8a4f16ea
UpperManagement.deleteDate emits list of sets, indexes in datawidget are now only updated once
2023-04-15 15:40:49 +02:00
Dominik Demuth
e41c42d573
move iteration of deleting sets inside undo
2023-04-15 14:55:14 +02:00
Dominik Demuth
c94231f9d9
add block to graphwindow to stop rescale/legend uupdates
2023-04-15 14:54:25 +02:00
Dominik Demuth
99bb196e5c
basic FC reading is working for different script version
2023-04-14 19:17:05 +02:00
Dominik Demuth
e5563d55d5
set graphs in fc reader
2023-04-14 17:58:14 +02:00
Dominik Demuth
abe6ca42c7
added build date of appimage as version; closes #48
2023-04-13 20:03:39 +02:00
Dominik Demuth
29518b9ea0
newer FC scripts are working, now older ones fail
2023-04-12 20:42:33 +02:00
Dominik Demuth
3793f67951
rate and time in exponential function was switched
2023-04-12 20:01:27 +02:00
Dominik Demuth
0251dea563
uncheck fits in data_table
2023-04-12 17:28:12 +02:00
Dominik Demuth
bc034cf4f4
set region flag correctly
2023-04-12 17:27:05 +02:00
Dominik Demuth
3e513a1231
update makefile
2023-04-11 19:06:35 +02:00
Dominik Demuth
ead30d127a
add C function for FFHS integration
2023-04-10 19:33:23 +02:00
Dominik Demuth
3b79c571fb
eval expression reuses ListWidgetItems of datasets; closes #31
2023-04-09 20:20:37 +02:00
Dominik Demuth
ee8ea4f2c5
remove epsilons from integration, now 50% faster
2023-04-09 19:37:22 +02:00
Dominik Demuth
2c0cdfbd68
add constant to ffhs
2023-04-09 19:37:18 +02:00
Dominik Demuth
767fa5f6fb
timer needs to be child of window
2023-04-09 19:37:01 +02:00
02f8a3bb31
fitting ( #43 )
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adjustments to fit to see if fit is at least running, could help with #39
Co-authored-by: Dominik Demuth <dominik.demuth@physik.tu-darmstadt.de>
Reviewed-on: #43
2023-04-08 18:37:07 +00:00
Dominik Demuth
ffecc9c873
remove duplicates of keys in deletion; may help with #36
2023-04-08 17:16:05 +02:00
0ec0021727
appimage-starter ( #42 )
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create program launcher;
reduced size of appimage;
download of appimages working(?)
Co-authored-by: Dominik Demuth <dominik.demuth@physik.tu-darmstadt.de>
Reviewed-on: #42
2023-04-08 13:28:13 +00:00
6b71de8265
bug-fixer ( #40 )
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fixes #32 , #34 , #39
Co-authored-by: Dominik Demuth <dominik.demuth@physik.tu-darmstadt.de>
Reviewed-on: #40
2023-04-07 13:45:28 +00:00
43285b4bd5
added first version of a backup system ( #37 )
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Co-authored-by: Dominik Demuth <dominik.demuth@physik.tu-darmstadt.de>
Reviewed-on: #37
2023-04-05 17:50:06 +00:00
2fbaa94109
catch strange behavior of strptime in get_zsync
2023-04-04 16:43:14 +00:00
ebf3e9635d
Update 'src/gui_qt/lib/utils.py'
2023-04-04 15:49:09 +00:00
79befb50f1
Update 'src/gui_qt/lib/utils.py'
2023-04-04 15:41:21 +00:00
0adb530dc2
Update 'src/gui_qt/lib/utils.py'
2023-04-04 15:34:09 +00:00
Dominik Demuth
d7fd8395e5
update zsync location
2023-04-02 19:44:01 +02:00
Dominik Demuth
75f9bc84f8
remove typo; remove unnecessary package
2023-04-02 19:23:04 +02:00
1c98676bee
Merge pull request 'show sub-functions in fitresult; closes #26 ' ( #28 ) from fitting into master
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Reviewed-on: #28
2023-04-02 15:42:05 +00:00
Dominik Demuth
8a35a5e6cb
show sub-functions in fitresult; closes #26
2023-04-02 17:40:23 +02:00
4e0ff4eddd
replace semicolon and commas with spaces in csv; closes #23
2023-03-24 11:03:50 +01:00
de9464ef9f
Update 'src/gui_qt/lib/utils.py'
2023-03-17 13:16:24 +00:00
466a63990d
Update 'src/gui_qt/lib/utils.py'
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logger added to zsync download
2023-03-17 13:15:44 +00:00
8690cb222e
ignore errors due to wrong encoding in agr files ( #22 )
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Co-authored-by: Dominik Demuth <dominik.demuth@physik.tu-darmstadt.de>
Reviewed-on: #22
2023-03-16 18:49:44 +00:00
28c15ff565
extrapolate_fit ( #21 )
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New sets with arbitrary x range can be created from fit results
Co-authored-by: Dominik Demuth <dominik.demuth@physik.tu-darmstadt.de>
Reviewed-on: #21
2023-03-12 19:37:10 +00:00
Dominik Demuth
1601f1455c
use same value in widget and multimodel to count parameter
2023-03-01 19:27:03 +01:00
Dominik Demuth
b73d6f08b8
asciireader.py avoid IndexError if file has no header
2023-03-01 19:27:03 +01:00
Dominik Demuth
df8a5e5699
redirect issue creation to gitea
2023-02-04 16:15:08 +01:00
Dominik Demuth
fec4103608
look for fits without parent during save; fixes T258
2023-02-02 17:09:04 +01:00
Dominik Demuth
0eb0a4be77
saving removes bad characters
2023-01-26 19:30:39 +01:00
Dominik Demuth
af313c7a58
GraceEditor now clears previously read graphs when calling; fixes T257
2023-01-23 18:45:42 +01:00
Dominik Demuth
bc14b26a5f
logging to Updater added
2023-01-20 18:25:29 +01:00
Dominik Demuth
aa33706f5b
update: new AppImage is executable
2023-01-16 20:16:40 +01:00
