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22f8bc80ed
concat mask also; closes #84
2023-06-19 18:15:25 +02:00
84d588cf80
work on export
2023-06-19 17:50:36 +02:00
5b146433f3
binning
2023-06-16 20:25:24 +02:00
1a225b2cd2
multiselection and check in graph and bdsdialog; part of #82
2023-06-15 20:16:42 +02:00
89c640e591
bugfix: remove value display item from graph before deletion
2023-06-15 20:00:52 +02:00
1703b8d514
add binning
2023-06-15 19:57:13 +02:00
7732544f69
start tg saving
2023-06-15 17:24:35 +02:00
988d2ccbda
minor cleanup
2023-06-13 20:28:37 +02:00
4268bdc5ae
#81 make t1 data real and catch more errors;
2023-06-13 19:08:24 +02:00
775b5e7e8a
correct tab behavior after value change (part of #79 )
2023-06-13 18:31:39 +02:00
30e148de14
Merge branch '79'
2023-06-12 20:40:28 +02:00
2499aac7a1
check for value changes while tabbing in edit mode, avoid signal; closes #79
2023-06-12 17:52:25 +02:00
f934104587
closes #80 ; evaluate expression an Datensätzen mit gehiddenen Values
2023-06-12 18:07:51 +02:00
6e976e1404
closes #78 interpolieren, auswahl von sets
2023-06-12 17:26:30 +02:00
92c29bec2a
split tg calculation from tnmh model
2023-06-12 17:20:58 +02:00
9f6d4e0d0c
split ficitive cp and tnmh
2023-06-05 19:57:42 +02:00
90bd33a680
check also for individual files in config directory; closes #76
2023-06-04 19:39:12 +02:00
26fea8f69f
remove temporary elements from graphs before deletion
2023-06-04 15:57:17 +02:00
25f7ff5616
ui adjustments
2023-06-03 20:27:56 +02:00
bec789318d
initialize plot at start
2023-06-03 17:04:14 +02:00
edc6af2762
fictive cp and tnmh model
2023-06-01 20:09:11 +02:00
eb1e657dab
more ui work
2023-05-31 19:35:03 +02:00
79a424c4bd
fix mismatched indexes between data and labels in asciireader
2023-05-31 17:21:56 +02:00
f74dd982ba
color to dsc curves in tg
2023-05-31 17:20:51 +02:00
a5a9561b54
Merge remote-tracking branch 'origin/master'
2023-05-30 17:42:38 +02:00
c8287c2dbf
fix missing return of comments in asciireader
2023-05-30 17:42:12 +02:00
a8a7e75501
plot DSC data and baselines
2023-05-30 17:36:44 +02:00
30750cc4ed
more ui
2023-05-26 18:22:13 +02:00
af14793286
more ui
2023-05-26 17:28:06 +02:00
2906c17472
more ui
2023-05-24 19:34:06 +02:00
5590b5cd16
SelectionWidget has no function show_as_local_parameter; fixes #75
Dominik Demuth
2023-05-24 09:00:31 +00:00
09e415babf
begin work on gui
2023-05-23 19:23:13 +02:00
4e2938b2a2
proper handling of sets without label,; closes #73
Dominik Demuth
2023-05-23 06:40:08 +00:00
685b9d2316
HN + Excess wing
2023-05-22 18:50:03 +02:00
b91fbf7621
tg evaluation in dsc
2023-05-22 18:49:49 +02:00
8d55430246
binning added to points
2023-05-22 18:49:27 +02:00
8d06240205
Merge branch 'fit'
2023-05-19 18:14:29 +02:00
65034d4518
sub function show numbering; closes #70
2023-05-19 18:13:57 +02:00
2adf15104f
attempt to only show real/imag part of complex fit functions; closes #72
2023-05-19 17:35:32 +02:00
cd9c85c12b
add FID as fallback option for dtype in nmrreader
2023-05-19 16:56:01 +02:00
84d136dd4c
.nmr files recognize all data types; closes #71
2023-05-19 16:53:54 +02:00
f60e125487
display parameter name with number ind window
2023-05-19 16:41:24 +02:00
1e9a390ae2
attempt to distinguish general and set-specifi parameter
2023-05-19 16:17:49 +02:00
8673e5acdb
catch error in f-test
2023-05-19 16:00:04 +02:00
66a0e40a23
display correct start parameter
2023-05-19 15:48:32 +02:00
a1ab6335c5
remove remnants of fitresult redesign; closes #68
2023-05-19 13:25:56 +02:00
09a2b61160
read text files as BDS and DSC
2023-05-19 13:02:58 +02:00
681b49a22f
Merge branch 'read_fc'
2023-05-19 11:37:42 +02:00
3dcd44c3ee
restore optionality to figure saving
2023-05-19 11:37:24 +02:00
6e9dd4d45f
use gnuplot as lightweight plotter
2023-05-19 11:33:02 +02:00
888d86d9fe
remove typo in AppImageBuilder.yml
2023-05-18 20:50:39 +02:00
67d60949b5
plot fit and residual together with bigger fit
2023-05-18 20:43:45 +02:00
fcaf43b3eb
fixed problem with setting color from context menu
2023-05-18 18:51:02 +02:00
49101565a3
fixed problem with setting color from context menu
2023-05-17 19:41:44 +02:00
255d7c7862
Update 'src/nmreval/io/dsc.py'
Dominik Demuth
2023-05-17 15:39:36 +00:00
12dacb73b3
add QMessageBox to display existing backup files
2023-05-16 20:05:55 +02:00
b127cc15e2
dsc: only use low temperature to baseline correct calibration without enthalpy
2023-05-16 19:22:50 +02:00
bc215ce32b
some stuff done
2023-05-16 17:45:39 +02:00
996b0b2ae2
tnm function with numpy arrays
2023-05-14 20:05:10 +02:00
753cd06dd1
pick position remembers selected destination graph; closes #62
2023-05-14 18:16:23 +02:00
45d319834b
fitresult window is reused and remembers fitplot range/log; closes #65 add color to sub-functions in fit result window Fitresult window shows one set at a time, more space for plot; closes #66
2023-05-12 20:13:56 +02:00
11ed3c16eb
add tnmh stuff
2023-05-13 19:23:15 +02:00
edf858da29
hacky solution to have correct tuda colors in agr file; closes #63
2023-05-11 20:12:32 +02:00
e10b85b904
more correct lines preview in asciireader
2023-05-11 18:28:03 +02:00
267554b252
check for empty line moved to avoid error
2023-05-11 18:00:29 +02:00
233cdd9f80
add gnuplot to requirements for plots of FC reading
2023-05-10 17:09:11 +02:00
15c959fd71
save fit parameter adds name to file as extra comment; possible solution for #59
2023-05-08 19:54:55 +02:00
1378cf6ac7
Fitresult accepts label argument as set name
2023-05-08 18:48:08 +02:00
a964e02612
correct baseline and slopes for calibration measurements at high DSC rates
2023-05-08 18:20:04 +02:00
a72e4ba833
add logging to fit exception to retain more info; all references to current graph are either None or id
2023-05-03 19:04:48 +02:00
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
adcd98fc31
dsc baseline uses consistent offset for correction; closes #53
2023-05-02 17:35:28 +02:00
d8cc99cea4
dsc (#55 )
Dominik Demuth
2023-04-30 18:21:16 +00:00
7671a56b6f
merge cfunc -> main
2023-04-30 14:59:58 +02:00
8086dd5276
finalized c functions
2023-04-29 20:40:32 +02:00
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
Dominik Demuth
2023-04-27 12:13:20 +02:00
35e89176be
datawidget.py: raise AttributeError manually if item is graph, was not always raised; maybe problem of #52
Dominik Demuth
2023-04-27 12:13:20 +02:00
ac4a4d3b8e
DSC: remove non-finite values due mismatch in beginnings of sample and empty
2023-04-24 19:24:23 +02:00
dd1c26e285
more work on loggaussian
2023-04-23 19:55:53 +02:00
eba7869c4d
data list in QEvalDialog uses current names instead of stored
2023-04-19 19:43:04 +02:00
efd5b34b13
create .local/bin folder for AppImage if not existent
2023-04-19 18:33:11 +02:00
2d472bd44e
lower epsabs for integration of energy barrier spec dens
2023-04-19 18:24:29 +02:00
2042148d0f
C function for energy distribution spectral density
2023-04-17 20:17:54 +02:00
4a9d50e8a4
refactor Log-Gaussian susceptibility
2023-04-17 17:43:18 +02:00
56b588293d
add loggausian to c func and move lookup of c library
2023-04-17 17:31:34 +02:00
59625c1581
more_bugs (#51 )
Dominik Demuth
2023-04-16 15:40:58 +00:00
bb3d5ac58b
remoce matplotlib import
2023-04-16 14:33:05 +02:00
48861c3f80
remove spurious print
2023-04-16 14:20:40 +02:00
8e2ebfc765
Merge branch 'more_bugs'
2023-04-16 14:17:36 +02:00
924b58beda
move iteration of deleting sets inside undo, fixes #36
2023-04-15 15:41:37 +02:00
bd8a4f16ea
UpperManagement.deleteDate emits list of sets, indexes in datawidget are now only updated once
2023-04-15 15:40:49 +02:00
e41c42d573
move iteration of deleting sets inside undo
2023-04-15 14:55:14 +02:00
c94231f9d9
add block to graphwindow to stop rescale/legend uupdates
2023-04-15 14:54:25 +02:00
99bb196e5c
basic FC reading is working for different script version
2023-04-14 19:17:05 +02:00
e5563d55d5
set graphs in fc reader
2023-04-14 17:58:14 +02:00
abe6ca42c7
added build date of appimage as version; closes #48
2023-04-13 20:03:39 +02:00
40961a89df
correct path in makefile
2023-04-13 19:38:58 +02:00
29518b9ea0
newer FC scripts are working, now older ones fail
2023-04-12 20:42:33 +02:00
3793f67951
rate and time in exponential function was switched
2023-04-12 20:01:27 +02:00
Dominik Demuth
Dominik Demuth