changeset 10:0c9f977e8d75 draft

planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/matchms commit f14275bfdc2caa760d71d307ca1803eab1adde76
author recetox
date Wed, 13 Mar 2024 10:18:20 +0000
parents ab784731b20e
children 20a6e3c081cc
files test-data/add_key/add_key_test2_out.msp test-data/out_matchms_remove_key.msp test-data/remove_key/out2_matchms_remove_key.msp test-data/remove_key/out_matchms_remove_key.msp
diffstat 4 files changed, 375 insertions(+), 188 deletions(-) [+]
line wrap: on
line diff
--- a/test-data/add_key/add_key_test2_out.msp	Thu Feb 22 12:30:53 2024 +0000
+++ b/test-data/add_key/add_key_test2_out.msp	Wed Mar 13 10:18:20 2024 +0000
@@ -16,6 +16,7 @@
 CHARGE: 1
 PARENT_MASS: 251.08595400000002
 ADDUCT: [M]+
+TOOL_USED: matchms
 NUM PEAKS: 3
 250.07765   0.3282529462971431
 252.09323   1.0
@@ -39,6 +40,7 @@
 CHARGE: 1
 PARENT_MASS: 177.070224
 ADDUCT: [M]+
+TOOL_USED: matchms
 NUM PEAKS: 5
 152.0619    0.1657993569424221
 176.062     0.24558560966311757
--- a/test-data/out_matchms_remove_key.msp	Thu Feb 22 12:30:53 2024 +0000
+++ /dev/null	Thu Jan 01 00:00:00 1970 +0000
@@ -1,188 +0,0 @@
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--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/remove_key/out2_matchms_remove_key.msp	Wed Mar 13 10:18:20 2024 +0000
@@ -0,0 +1,184 @@
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--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/remove_key/out_matchms_remove_key.msp	Wed Mar 13 10:18:20 2024 +0000
@@ -0,0 +1,189 @@
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