@complat/react-spectra-editor 1.7.1 → 1.8.0
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/CHANGELOG.md +28 -0
- package/LICENSE +21 -662
- package/README.md +5 -0
- package/dist/__tests__/fixtures/lc_ms_jcamp.js +2329 -0
- package/dist/__tests__/fixtures/lc_ms_jcamp_2.js +2874 -0
- package/dist/__tests__/fixtures/lc_ms_jcamp_mz_chemstation.js +3242 -0
- package/dist/__tests__/fixtures/lc_ms_jcamp_tic_chemstation.js +854 -0
- package/dist/__tests__/fixtures/lc_ms_jcamp_tic_neg.js +1233 -0
- package/dist/__tests__/fixtures/lc_ms_jcamp_tic_pos.js +1233 -0
- package/dist/__tests__/fixtures/lc_ms_jcamp_uvvis.js +48908 -0
- package/dist/__tests__/fixtures/lc_ms_jcamp_uvvis_chemstation.js +15424 -0
- package/dist/__tests__/units/components/cmd_bar/r05_submit_btn.test.js +158 -3
- package/dist/__tests__/units/components/d3_line_rect.test.js +85 -0
- package/dist/__tests__/units/components/d3_multi/multi_focus.test.js +43 -0
- package/dist/__tests__/units/components/hplc_viewer.test.js +123 -0
- package/dist/__tests__/units/components/panel/info.test.js +55 -15
- package/dist/__tests__/units/features/lc-ms/parsing/lcmsCategory.test.js +73 -0
- package/dist/__tests__/units/features/lc-ms/submit/peaks.test.js +310 -0
- package/dist/actions/curve.js +5 -2
- package/dist/actions/hplc_ms.js +66 -0
- package/dist/actions/integration.js +17 -2
- package/dist/actions/ui.js +39 -11
- package/dist/app.js +21 -8
- package/dist/components/cmd_bar/01_viewer.js +15 -11
- package/dist/components/cmd_bar/03_peak.js +25 -16
- package/dist/components/cmd_bar/04_integration.js +116 -17
- package/dist/components/cmd_bar/08_peak_group.js +83 -0
- package/dist/components/cmd_bar/collapsible_toolbar_group.js +101 -0
- package/dist/components/cmd_bar/common.js +4 -3
- package/dist/components/cmd_bar/index.js +76 -18
- package/dist/components/cmd_bar/r01_layout.js +6 -0
- package/dist/components/cmd_bar/r02_scan.js +15 -11
- package/dist/components/cmd_bar/r03_threshold.js +19 -3
- package/dist/components/cmd_bar/r04_submit.js +61 -6
- package/dist/components/cmd_bar/r05_submit_btn.js +60 -13
- package/dist/components/cmd_bar/r06_predict_btn.js +4 -4
- package/dist/components/cmd_bar/r07_wavelength_btn.js +10 -9
- package/dist/components/cmd_bar/r09_detector.js +2 -2
- package/dist/components/cmd_bar/tri_btn.js +4 -1
- package/dist/components/common/draw.js +6 -5
- package/dist/components/d3_line/index.js +70 -15
- package/dist/components/d3_line/line_focus.js +104 -67
- package/dist/components/d3_line_rect/index.js +836 -0
- package/dist/components/d3_line_rect/line_focus.js +526 -0
- package/dist/components/d3_line_rect/multi_focus.js +433 -0
- package/dist/components/d3_line_rect/rect_focus.js +247 -0
- package/dist/components/d3_multi/index.js +154 -163
- package/dist/components/d3_multi/multi_focus.js +117 -68
- package/dist/components/d3_rect/index.js +6 -0
- package/dist/components/d3_rect/rect_focus.js +17 -5
- package/dist/components/hplc_viewer.js +169 -0
- package/dist/components/lc_ms_uv_tools_bar.js +175 -0
- package/dist/components/multi_jcamps_viewer.js +17 -5
- package/dist/components/panel/compare.js +84 -62
- package/dist/components/panel/cyclic_voltamery_data.js +15 -14
- package/dist/components/panel/graph_selection.js +32 -30
- package/dist/components/panel/index.js +28 -22
- package/dist/components/panel/info.js +75 -26
- package/dist/constants/action_type.js +23 -2
- package/dist/constants/list_graph.js +16 -0
- package/dist/constants/list_layout.js +2 -1
- package/dist/constants/list_ui.js +5 -2
- package/dist/features/lc-ms/entities/extractEntityLCMS.js +187 -0
- package/dist/features/lc-ms/parsing/chemstation.js +108 -0
- package/dist/features/lc-ms/parsing/index.js +46 -0
- package/dist/features/lc-ms/parsing/lcmsCategory.js +44 -0
- package/dist/features/lc-ms/parsing/lcmsJcampInfo.js +18 -0
- package/dist/features/lc-ms/parsing/lcmsMsPage.js +241 -0
- package/dist/features/lc-ms/parsing/pageValue.js +27 -0
- package/dist/features/lc-ms/submit/index.js +24 -0
- package/dist/features/lc-ms/submit/peaks.js +66 -0
- package/dist/features/lc-ms/ui/wavelengthSelect.js +54 -0
- package/dist/fn.js +4 -1
- package/dist/helpers/brush.js +74 -19
- package/dist/helpers/calc.js +4 -2
- package/dist/helpers/cfg.js +5 -4
- package/dist/helpers/chem.js +449 -71
- package/dist/helpers/compass.js +181 -17
- package/dist/helpers/extractEntityLCMS.js +24 -0
- package/dist/helpers/extractParams.js +118 -33
- package/dist/helpers/extractPeaksEdit.js +29 -9
- package/dist/helpers/format.js +189 -4
- package/dist/helpers/init.js +25 -5
- package/dist/helpers/integration.js +130 -17
- package/dist/helpers/integration_draft.js +43 -0
- package/dist/helpers/integration_focus.js +155 -0
- package/dist/helpers/integration_jcamp.js +68 -0
- package/dist/helpers/integration_split.js +202 -0
- package/dist/helpers/mount.js +8 -1
- package/dist/helpers/sweep.js +39 -0
- package/dist/index.js +284 -26
- package/dist/layer_content.js +17 -3
- package/dist/layer_init.js +124 -14
- package/dist/layer_prism.js +31 -5
- package/dist/reducers/index.js +3 -1
- package/dist/reducers/reducer_curve.js +54 -36
- package/dist/reducers/reducer_hplc_ms/hydrate.js +289 -0
- package/dist/reducers/reducer_hplc_ms/index.js +122 -0
- package/dist/reducers/reducer_hplc_ms/persistence.js +74 -0
- package/dist/reducers/reducer_hplc_ms/tic.js +70 -0
- package/dist/reducers/reducer_hplc_ms/utils.js +70 -0
- package/dist/reducers/reducer_hplc_ms/uvvis.js +377 -0
- package/dist/reducers/reducer_integration.js +265 -7
- package/dist/reducers/reducer_layout.js +1 -1
- package/dist/reducers/reducer_submit.js +2 -1
- package/dist/reducers/reducer_ui.js +149 -13
- package/dist/reducers/undo_redo_config.js +2 -2
- package/dist/sagas/saga_lcms_ui.js +85 -0
- package/dist/sagas/saga_ui.js +177 -74
- package/dist/setupTests.js +5 -5
- package/package.json +10 -7
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Object.defineProperty(exports, "__esModule", {
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value: true
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});
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exports.default = void 0;
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const lcmsJcamp2 = `
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##TITLE=Spectrum
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##JCAMP-DX=5.00 $$ chemotion-converter-app (1.8.0)
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##DATA TYPE=MASS SPECTRUM
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##DATA CLASS=NTUPLES
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##ORIGIN=
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##OWNER=
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##XUNITS=m/z
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##YUNITS=Intensity
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##SOFTWARE=openlab
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##SCAN_MODE=positiv
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##TYPE=ms spectrum
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##NTUPLES=MULTIDIMENSIONAL
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##VAR_NAME=T, m/z, Intensity
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##SYMBOL=T, X, Y
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##VAR_TYPE=PAGE, X, Y
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##VAR_DIM=1200, 1189, 1189
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##UNITS=, m/z, Intensity
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##PAGE=T= 0.004666666666666667
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1900
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1911
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1914
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1918
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1920
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1927
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1928
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1929
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1930
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1931
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1932
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1933
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1934
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1935
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1936
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1937
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1938
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1939
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1940
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1941
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1942
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1943
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1944
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1945
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1946
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1947
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1948
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1949
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1950
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1951
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1952
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1953
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1954
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1955
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317.1000061035156, 7.04127911445922
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1956
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1957
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319.6000061035156, 7.594742101621954
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1958
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1959
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321.20001220703125, 4.281651164578369
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1960
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1961
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1962
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323.5, 28.787762318394957
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1963
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324.5, 3.15935121838727
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1964
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325.1000061035156, 3.8050580367437927
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1965
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326.1000061035156, 1.7065108770850947
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1966
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1967
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1968
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1969
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1970
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333.0, 4.773618264278576
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1971
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1972
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336.1000061035156, 5.680682604350833
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1973
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337.3999938964844, 8.79391190714121
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1974
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1975
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1976
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1977
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343.1000061035156, 6.902913367668536
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1978
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345.0, 3.282342993312322
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1979
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346.6000061035156, 5.680682604350833
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1980
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349.1000061035156, 5.7959873933430694
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1981
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1982
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1983
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1984
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1985
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1986
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1987
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1988
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1989
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1990
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361.1000061035156, 3.4745176416327155
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1991
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1992
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1993
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1994
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1995
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1996
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1997
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1998
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1999
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2000
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2001
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2002
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2003
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2004
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2005
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2006
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2007
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2008
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2009
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2010
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2011
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2012
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2014
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2018
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2020
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2119
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1396.199951171875, 2.359904681374433
|
|
2827
|
+
1397.800048828125, 0.16142670458913058
|
|
2828
|
+
1399.300048828125, 2.167730033054039
|
|
2829
|
+
1399.9000244140625, 1.6296410177569374
|
|
2830
|
+
1402.5, 1.5066492428318856
|
|
2831
|
+
1403.199951171875, 0.13836574679068336
|
|
2832
|
+
1404.0, 0.7994465370128372
|
|
2833
|
+
1405.0999755859375, 0.238296563917288
|
|
2834
|
+
1405.5, 0.13836574679068336
|
|
2835
|
+
1407.4000244140625, 2.9441156122684293
|
|
2836
|
+
1408.4000244140625, 0.1998616342532093
|
|
2837
|
+
1409.5, 1.729571834883542
|
|
2838
|
+
1410.199951171875, 0.5457760012299178
|
|
2839
|
+
1411.0999755859375, 5.350142209239757
|
|
2840
|
+
1414.300048828125, 2.982550541932508
|
|
2841
|
+
1415.4000244140625, 1.6603889614882004
|
|
2842
|
+
1416.0999755859375, 2.0985471596586978
|
|
2843
|
+
1416.5999755859375, 2.513644400030748
|
|
2844
|
+
1417.5999755859375, 0.4919670997002075
|
|
2845
|
+
1418.5999755859375, 1.0069951571988622
|
|
2846
|
+
1420.4000244140625, 3.0132984856637712
|
|
2847
|
+
1421.0999755859375, 0.1460527327234991
|
|
2848
|
+
1421.5, 0.13836574679068336
|
|
2849
|
+
1422.5999755859375, 0.4458451841033131
|
|
2850
|
+
1423.0999755859375, 0.2921054654469982
|
|
2851
|
+
1424.699951171875, 0.983934199400415
|
|
2852
|
+
1426.300048828125, 2.9056806826043506
|
|
2853
|
+
1427.4000244140625, 5.319394265508494
|
|
2854
|
+
1429.0, 2.0216773003305404
|
|
2855
|
+
1429.9000244140625, 0.2767314935813667
|
|
2856
|
+
1430.4000244140625, 0.09993081712660465
|
|
2857
|
+
1432.800048828125, 0.22292259205165654
|
|
2858
|
+
1434.0999755859375, 1.3605965101083863
|
|
2859
|
+
1435.300048828125, 2.3675916673072486
|
|
2860
|
+
1436.9000244140625, 4.012606656929818
|
|
2861
|
+
1438.5, 2.9518025982012452
|
|
2862
|
+
1439.199951171875, 0.24598354985010376
|
|
2863
|
+
1440.0, 0.22292259205165654
|
|
2864
|
+
1440.9000244140625, 0.35360135290952416
|
|
2865
|
+
1441.800048828125, 0.1460527327234991
|
|
2866
|
+
1442.5999755859375, 0.0538089015297102
|
|
2867
|
+
1444.5, 0.3766623107079714
|
|
2868
|
+
1446.0999755859375, 1.1453609039895456
|
|
2869
|
+
1447.0, 0.3997232685064186
|
|
2870
|
+
1447.5999755859375, 0.18448766238757783
|
|
2871
|
+
##END NTUPLES
|
|
2872
|
+
|
|
2873
|
+
`;
|
|
2874
|
+
var _default = exports.default = lcmsJcamp2;
|