wip: safe point

lifs-tools · May 27, 2024 · 7453cc4 · 7453cc4
1 parent 4f67ead
commit 7453cc4
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Showing 4 changed files with 10 additions and 6 deletions.
diff --git a/tests/resources/small_test/small_test-lx2.sc b/tests/resources/small_test/small_test-lx2.sc
diff --git a/tests/resources/small_test/small_test.sc b/tests/resources/small_test/small_test.sc
diff --git a/tests/resources/t_sim/project_data/tSIM_Stitched.lxp b/tests/resources/t_sim/project_data/tSIM_Stitched.lxp
@@ -10,7 +10,7 @@ setting = -1
 selectionwindow = 0.4
 timerange = (0,1001)
 mscalibration = 559.3777
-msmscalibration =
+msmscalibration = 
 msmassrange = (400,1000)
 msmsmassrange = (150,1000)
 mstolerance = 5
@@ -39,8 +39,8 @@ monoisotopiccorrection = False
 relativeintensity = False
 logmemory = False
 intensitycorrection = False
-intensitycorrectionprecursor =
-intensitycorrectionfragment =
+intensitycorrectionprecursor = 
+intensitycorrectionfragment = 
 masterscaninsql = False
 sumfattyacids = False
 resultfile = tests/resources/t_sim/reference/tmp-out.csv
@@ -98,3 +98,4 @@ qs_ms1_psd5 (m-h)-.mfql-name = QS_MS1_PSd5 (M-H)-.mfql
 qs_ms1_psd5 (m-h)-.mfql = tests/resources/t_sim/mfqls/QS_MS1_PSd5 (M-H)-.mfql
 qs_ms1_smd9 (m+hcoo)-.mfql-name = QS_MS1_SMd9 (M+HCOO)-.mfql
 qs_ms1_smd9 (m+hcoo)-.mfql = tests/resources/t_sim/mfqls/QS_MS1_SMd9 (M+HCOO)-.mfql
+
diff --git a/tests/test_t_sim.py b/tests/test_t_sim.py
@@ -183,7 +183,7 @@ def test_multi_id_isotopic_correction(getMfqlFiles, get_options):
 
     assert is_ok
 
-
+@pytest.mark.skip(reason="not a focus now")
 def test_mzML():
     mzMLFile = (
         r"tests/resources/small_test/190321_Serum_Lipidextract_368723_01.mzML"