diff test-data/bsa.mzML @ 8:16080891c80d

Uploaded

--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/bsa.mzML	Tue Mar 05 00:48:00 2013 -0500
@@ -0,0 +1,96 @@
+<?xml version="1.0" encoding="ISO-8859-1"?>
+<indexedmzML xmlns="http://psi.hupo.org/ms/mzml" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://psi.hupo.org/ms/mzml http://psidev.info/files/ms/mzML/xsd/mzML1.1.1_idx.xsd">
+  <mzML xmlns="http://psi.hupo.org/ms/mzml" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://psi.hupo.org/ms/mzml http://psidev.info/files/ms/mzML/xsd/mzML1.1.0.xsd" id="bsa" version="1.1.0">
+    <cvList count="2">
+      <cv id="MS" fullName="Proteomics Standards Initiative Mass Spectrometry Ontology" version="3.30.0" URI="http://psidev.cvs.sourceforge.net/*checkout*/psidev/psi/psi-ms/mzML/controlledVocabulary/psi-ms.obo"/>
+      <cv id="UO" fullName="Unit Ontology" version="12:10:2011" URI="http://obo.cvs.sourceforge.net/*checkout*/obo/obo/ontology/phenotype/unit.obo"/>
+    </cvList>
+    <fileDescription>
+      <fileContent>
+        <cvParam cvRef="MS" accession="MS:1000580" name="MSn spectrum" value=""/>
+        <cvParam cvRef="MS" accession="MS:1000127" name="centroid spectrum" value=""/>
+      </fileContent>
+      <sourceFileList count="1">
+        <sourceFile id="bsa.mgf" name="bsa.mgf" location="file:///">
+          <cvParam cvRef="MS" accession="MS:1000774" name="multiple peak list nativeID format" value=""/>
+          <cvParam cvRef="MS" accession="MS:1001062" name="Mascot MGF file" value=""/>
+          <cvParam cvRef="MS" accession="MS:1000569" name="SHA-1" value="92c6fa5d4ff59e2124950546a651bb9a85bbfd92"/>
+        </sourceFile>
+      </sourceFileList>
+    </fileDescription>
+    <softwareList count="1">
+      <software id="pwiz_3.0.4140" version="3.0.4140">
+        <cvParam cvRef="MS" accession="MS:1000615" name="ProteoWizard" value=""/>
+      </software>
+    </softwareList>
+    <instrumentConfigurationList count="1">
+      <instrumentConfiguration id="IC">
+        <cvParam cvRef="MS" accession="MS:1000031" name="instrument model" value=""/>
+      </instrumentConfiguration>
+    </instrumentConfigurationList>
+    <dataProcessingList count="1">
+      <dataProcessing id="pwiz_Reader_conversion">
+        <processingMethod order="0" softwareRef="pwiz_3.0.4140">
+          <cvParam cvRef="MS" accession="MS:1000544" name="Conversion to mzML" value=""/>
+        </processingMethod>
+        <processingMethod order="1" softwareRef="pwiz_3.0.4140">
+          <userParam name="most intense count (excluding ties at the threshold)" value="100"/>
+        </processingMethod>
+      </dataProcessing>
+    </dataProcessingList>
+    <run id="bsa" defaultInstrumentConfigurationRef="IC">
+      <spectrumList count="1" defaultDataProcessingRef="pwiz_Reader_conversion">
+        <spectrum index="0" id="index=0" defaultArrayLength="97" dataProcessingRef="pwiz_Reader_conversion">
+          <cvParam cvRef="MS" accession="MS:1000580" name="MSn spectrum" value=""/>
+          <cvParam cvRef="MS" accession="MS:1000511" name="ms level" value="2"/>
+          <cvParam cvRef="MS" accession="MS:1000127" name="centroid spectrum" value=""/>
+          <cvParam cvRef="MS" accession="MS:1000796" name="spectrum title" value="Cmpd 1, +MSn(722.3522), 33.5 min"/>
+          <cvParam cvRef="MS" accession="MS:1000130" name="positive scan" value=""/>
+          <cvParam cvRef="MS" accession="MS:1000528" name="lowest observed m/z" value="198.13402"/>
+          <cvParam cvRef="MS" accession="MS:1000527" name="highest observed m/z" value="1280.62643"/>
+          <cvParam cvRef="MS" accession="MS:1000285" name="total ion current" value="21166.0"/>
+          <cvParam cvRef="MS" accession="MS:1000504" name="base peak m/z" value="249.17284"/>
+          <cvParam cvRef="MS" accession="MS:1000505" name="base peak intensity" value="2164.0"/>
+          <scanList count="1">
+            <cvParam cvRef="MS" accession="MS:1000795" name="no combination" value=""/>
+            <scan>
+            </scan>
+          </scanList>
+          <precursorList count="1">
+            <precursor>
+              <selectedIonList count="1">
+                <selectedIon>
+                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="722.35225	26693" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                  <cvParam cvRef="MS" accession="MS:1000041" name="charge state" value="2"/>
+                </selectedIon>
+              </selectedIonList>
+              <activation>
+              </activation>
+            </precursor>
+          </precursorList>
+          <binaryDataArrayList count="2">
+            <binaryDataArray encodedLength="1036">
+              <cvParam cvRef="MS" accession="MS:1000523" name="64-bit float" value=""/>
+              <cvParam cvRef="MS" accession="MS:1000576" name="no compression" value=""/>
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+            </binaryDataArray>
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+              <cvParam cvRef="MS" accession="MS:1000576" name="no compression" value=""/>
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+            </binaryDataArray>
+          </binaryDataArrayList>
+        </spectrum>
+      </spectrumList>
+    </run>
+  </mzML>
+  <indexList count="2">
+    <index name="spectrum">
+      <offset idRef="index=0">2685</offset>
+    </index>
+  </indexList>
+  <indexListOffset>7058</indexListOffset>
+  <fileChecksum>b76171188a63cfad075d3738a172b15f1f9e0c4c</fileChecksum>
+</indexedmzML>