pyopenms 2.3.0__zip
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.
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/License.txt +52 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/__init__.py +54 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/__init__.pyc +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/all_modules.py +4 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/all_modules.pyc +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/docompile.py +35 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/docompile.pyc +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/libOpenMS.so +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/libOpenSwathAlgo.so +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/libSuperHirn.so +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/pyopenms_1.so +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/pyopenms_2.so +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/pyopenms_3.so +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/pyopenms_4.so +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/python_extras.py +22 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/python_extras.pyc +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/qt_version_info.py +2 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/qt_version_info.pyc +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/Elements.xml +1221 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/Enzymes.xml +269 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/HMDBMappingFile.tsv +10104 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/MetaboliteIsoModel.scale +6 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/MetaboliteIsoModel.svm +626 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/MetaboliteIsoModelNoised2.scale +4 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/MetaboliteIsoModelNoised2.svm +559 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/MetaboliteIsoModelNoised5.scale +4 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/MetaboliteIsoModelNoised5.svm +1010 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/MissedCleavage.model +229 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/NegativeAdducts.tsv +15 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/OMSSA_modification_mapping +158 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/PSI-MOD.obo +23804 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/PositiveAdducts.tsv +33 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/Residues.xml +470 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/XLMOD.obo +623 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/XTandem_default_input.xml +181 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CHEMISTRY/unimod.xml +38885 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CV/brenda.obo +22923 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CV/goslim_goa.obo +823 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CV/psi-ms.obo +17899 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CV/psi-mzdata.obo +2920 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CV/qc-cv.obo +471 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CV/quality.obo +12581 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CV/unimod.obo +13214 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/CV/unit.obo +2585 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/DESKTOP/TOPPAS.appdata.xml +33 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/DESKTOP/TOPPAS.desktop +10 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/DESKTOP/TOPPView.appdata.xml +35 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/DESKTOP/TOPPView.desktop +11 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/DESKTOP/readme.txt +5 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/GUISTYLE/qtStyleSheet.qss +9 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/IDPool/IDPool.txt +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/IDPool/README +29 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/MAPPING/TraML-mapping.xml +171 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/MAPPING/ms-mapping.xml +187 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/MAPPING/mzIdentML-mapping.xml +221 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/MAPPING/mzdata-mapping.xml +158 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/PIP/codebooks.data +2 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/PIP/linearMapping.data +2 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/CTD_0_3.xsd +168 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/ConsensusXML_1_0.xsd +376 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/ConsensusXML_1_1.xsd +381 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/ConsensusXML_1_2.xsd +202 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/ConsensusXML_1_3.xsd +686 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/ConsensusXML_1_4.xsd +694 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/ConsensusXML_1_5.xsd +698 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/ConsensusXML_1_6.xsd +613 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/ConsensusXML_1_7.xsd +618 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/CvMapping.xsd +157 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FeatureXML_1_0.xsd +737 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FeatureXML_1_1.xsd +770 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FeatureXML_1_2.xsd +770 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FeatureXML_1_3.xsd +660 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FeatureXML_1_4.xsd +660 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FeatureXML_1_5.xsd +670 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FeatureXML_1_6.xsd +674 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FeatureXML_1_7.xsd +679 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FeatureXML_1_8.xsd +587 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FeatureXML_1_9.xsd +592 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/FuGElightv1.0.0.xsd +1118 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/IdXML_1_0.xsd +340 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/IdXML_1_1.xsd +345 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/IdXML_1_2.xsd +354 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/IdXML_1_3.xsd +367 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/IdXML_1_4.xsd +371 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/IdXML_1_5.xsd +371 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/Param_1_0.xsd +91 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/Param_1_1.xsd +101 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/Param_1_2.xsd +168 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/Param_1_3.xsd +173 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/Param_1_4.xsd +149 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/Param_1_6_2.xsd +99 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/ToolDescriptor_1_0.xsd +232 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/TraML0.9.3.xsd +552 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/TraML1.0.0.xsd +622 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/TrafoXML_1_0.xsd +102 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/general_types_1.0.xsd +17 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzData_1_05.xsd +631 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzIdentML1.0.0.xsd +1339 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzIdentML1.1.0.xsd +1845 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzML_1_00.xsd +921 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzML_1_10.xsd +1119 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzML_idx_1_00.xsd +992 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzML_idx_1_10.xsd +1201 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzQCML_0_0_5.xsd +220 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzQuantML_1_0_0-rc2.xsd +1557 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzXML_2_1.xsd +1 -1
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzXML_3.1.xsd +1 -1
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzXML_3.1_mod.xsd +686 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/mzXML_idx_3.1.xsd +60 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/pepXML_v114.xsd +1448 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/protXML_v6.xsd +935 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/qcML_0.0.7.xsd +235 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/separation_technique_1.0.xsd +10 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCHEMAS/xQuest_1_0.xsd +210 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/InternalCalibration_Models.R +40 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/InternalCalibration_Residuals.R +57 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/ProduceQCFigures_acc.R +28 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/ProduceQCFigures_idmap.R +39 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/ProduceQCFigures_inj.R +27 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/ProduceQCFigures_rt_acc.R +31 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/ProduceQCFigures_setid.R +27 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/ProduceQCFigures_tic.R +23 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/Rscript_generic_example.R +88 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/mzTab2tsv_PEP.R +47 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/mzTab2tsv_PRT.R +104 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/mzTab2tsv_PSM.R +80 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/SCRIPTS/plot_trafo.R +126 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/THIRDPARTY/ReadMe.txt +9 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Hardkloer.ttd +109 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/LINUX/TPP_ProteinProphet.ttd +46 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/LINUX/mail.ttd +22 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/MSGFtoPercolator.ttd +30 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/MascotPercolator.ttd +42 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Percolator.ttd +29 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/QCExporter.ttd +51 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/RawDirConvert.ttd +25 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/ReadMe.txt +72 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Rscript_generic.ttd +42 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Rscript_mzTab2tsv_PEP.ttd +26 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Rscript_mzTab2tsv_PRT.ttd +26 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Rscript_mzTab2tsv_PSM.ttd +26 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Rscript_qcfigures_acc.ttd +30 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Rscript_qcfigures_idmap.ttd +33 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Rscript_qcfigures_rt_acc.ttd +30 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Rscript_qcfigures_setid.ttd +30 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Rscript_qcfigures_tic.ttd +30 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/Rscript_qcfigures_trapfill.ttd +30 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/TEMPLATE.ttd_ +52 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/TPP_RefreshParser.ttd +28 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/WINDOWS/TPP_ProteinProphet.ttd +46 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/XTandemToPercolator.ttd +30 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/TOOLS/EXTERNAL/msconvert.ttd +25 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/XSL/APML_to_CSV.xsl +43 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/XSL/ConsensusXML.xsl +76 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/XSL/IdXML.xsl +210 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/share/OpenMS/XSL/QcML_report_sheet.xsl +548 -0
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- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/sysinfo.py +47 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/sysinfo.pyc +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/version.py +1 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms/version.pyc +0 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms-2.3.0-py2.7.egg-info/PKG-INFO +108 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms-2.3.0-py2.7.egg-info/SOURCES.txt +158 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms-2.3.0-py2.7.egg-info/dependency_links.txt +1 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms-2.3.0-py2.7.egg-info/not-zip-safe +1 -0
- media/doc/pyenv/py27_bleeding/lib/python2.7/site-packages/pyopenms-2.3.0-py2.7.egg-info/top_level.txt +5 -0
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<?xml version="1.0" encoding="UTF-8"?>
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<!-- edited with XMLSPY v2004 rel. 4 U (http://www.xmlspy.com) by Wei Yan (Institute for Systems Biology) -->
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<!--W3C Schema generated by XMLSPY v2004 rel. 4 U (http://www.xmlspy.com)-->
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<xs:schema targetNamespace="http://regis-web.systemsbiology.net/protXML" xmlns:xs="http://www.w3.org/2001/XMLSchema" xmlns="http://regis-web.systemsbiology.net/protXML" xmlns:protx="http://regis-web.systemsbiology.net/protXML" elementFormDefault="qualified">
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<xs:element name="ASAPRatio_pvalue">
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<xs:annotation>
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<xs:documentation>Results of ASAPRatio pvalue analysis (adjusting ASAPRatio ratios for offset of dataset, and determining whether ratios are significantly different from chance values originating from 1:1 proteins)</xs:documentation>
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</xs:annotation>
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<xs:complexType>
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<xs:attribute name="adj_ratio_mean" type="xs:double" use="required">
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<xs:annotation>
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<xs:documentation>Ratio adjusted for dataset mean value</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="adj_ratio_standard_dev" type="xs:double" use="required">
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<xs:annotation>
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<xs:documentation>Error adjusted for dataset mean value</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="heavy2light_adj_ratio_mean" type="xs:double">
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<xs:annotation>
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<xs:documentation>Heavy2light ratio adjusted for dataset mean value</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="heavy2light_adj_ratio_standard_dev" type="xs:double">
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<xs:annotation>
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<xs:documentation>Heavy2light error adjusted for dataset mean value</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="pvalue" type="xs:double">
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<xs:annotation>
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<xs:documentation>pvalue (probability of ratio due by chance to 1:1 protein)</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="decimal_pvalue" type="xs:double">
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<xs:annotation>
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<xs:documentation>decimal representation of pvalue</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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</xs:complexType>
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</xs:element>
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<xs:element name="ASAPRatio">
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<xs:annotation>
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<xs:documentation>Results of ASAPRatio quantitation of protein</xs:documentation>
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</xs:annotation>
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<xs:complexType>
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<xs:sequence>
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<xs:element name="ASAP_Seq" minOccurs="0" maxOccurs="unbounded">
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<xs:complexType>
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<xs:sequence>
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<xs:element name="ASAP_Peak" maxOccurs="unbounded">
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<xs:complexType>
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<xs:sequence>
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<xs:element name="ASAP_Dta" maxOccurs="unbounded">
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<xs:complexType>
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<xs:attribute name="peptide_index" type="xs:string" use="required"/>
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<xs:attribute name="include" type="xs:string" use="required"/>
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</xs:complexType>
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</xs:element>
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</xs:sequence>
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<xs:attribute name="status" type="xs:string" use="required"/>
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<xs:attribute name="include" type="xs:string" use="required"/>
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<xs:attribute name="datanum" type="xs:nonNegativeInteger" use="required"/>
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<xs:attribute name="ratio_mean" type="xs:double" use="required"/>
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<xs:attribute name="ratio_standard_dev" type="xs:double" use="required"/>
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<xs:attribute name="heavy2light_ratio_mean" type="xs:double" use="required"/>
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<xs:attribute name="heavy2light_ratio_standard_dev" type="xs:double" use="required"/>
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<xs:attribute name="weight" type="xs:double" use="required"/>
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<xs:attribute name="peptide_binary_ind" type="xs:string" use="required"/>
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</xs:complexType>
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</xs:element>
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</xs:sequence>
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<xs:attribute name="status" type="xs:string" use="required"/>
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<xs:attribute name="include" type="xs:string" use="required"/>
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<xs:attribute name="datanum" type="xs:nonNegativeInteger" use="required"/>
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<xs:attribute name="ratio_mean" type="xs:double" use="required"/>
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<xs:attribute name="ratio_standard_dev" type="xs:double" use="required"/>
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<xs:attribute name="heavy2light_ratio_mean" type="xs:double" use="required"/>
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<xs:attribute name="heavy2light_ratio_standard_dev" type="xs:double" use="required"/>
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<xs:attribute name="weight" type="xs:double" use="required"/>
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<xs:attribute name="light_sequence" type="xs:string" use="required"/>
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</xs:complexType>
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</xs:element>
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</xs:sequence>
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<xs:attribute name="ratio_mean" type="xs:double" use="required"/>
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<xs:attribute name="ratio_standard_dev" type="xs:double" use="required"/>
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<xs:attribute name="ratio_number_peptides" type="xs:nonNegativeInteger" use="required"/>
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<xs:attribute name="heavy2light_ratio_mean" type="xs:double"/>
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<xs:attribute name="heavy2light_ratio_standard_dev" type="xs:double"/>
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<xs:attribute name="description" type="xs:string"/>
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<xs:attribute name="status" type="xs:string"/>
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<xs:attribute name="peptide_inds" type="xs:string"/>
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</xs:complexType>
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</xs:element>
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<xs:element name="protein_summary">
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<xs:complexType>
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<xs:sequence>
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<xs:element name="protein_summary_header">
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<xs:complexType>
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<xs:sequence>
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<xs:element name="program_details">
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<xs:complexType>
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<xs:sequence>
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<xs:any namespace="##any" processContents="lax" minOccurs="0">
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<xs:annotation>
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<xs:documentation>Wildcard for summary info customized for a particular analysis used to infer protein identifications</xs:documentation>
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</xs:annotation>
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</xs:any>
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</xs:sequence>
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<xs:attribute name="analysis" type="xs:string" use="required">
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<xs:annotation>
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<xs:documentation>Name of analysis used for protein identifications</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="time" type="xs:dateTime" use="required">
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<xs:annotation>
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<xs:documentation>Time of analysis</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="version" type="xs:string"/>
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</xs:complexType>
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</xs:element>
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</xs:sequence>
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<xs:attribute name="reference_database" type="xs:string" use="required">
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<xs:annotation>
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<xs:documentation>full path database name</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="win-cyg_reference_database" type="xs:string">
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<xs:annotation>
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<xs:documentation>windows full path database</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="residue_substitution_list" type="xs:string">
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<xs:annotation>
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<xs:documentation>residues considered equivalent when comparing peptides</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="organism" type="xs:string">
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<xs:annotation>
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<xs:documentation>sample organism (used for annotation purposes)</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="source_files" type="xs:string" use="required">
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<xs:annotation>
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<xs:documentation>input pepXML files</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="source_files_alt" type="xs:string" use="required"/>
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<xs:attribute name="win-cyg_source_files" type="xs:string">
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<xs:annotation>
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<xs:documentation>windows pepXML file names</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="source_file_xtn" type="xs:string">
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<xs:annotation>
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<xs:documentation>file type (if not pepXML)</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="min_peptide_probability" type="xs:double" use="required">
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<xs:annotation>
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<xs:documentation>minimum adjusted peptide probability contributing to protein probability</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="min_peptide_weight" type="xs:double" use="required">
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<xs:annotation>
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<xs:documentation>minimum peptide weight contributing to protein probability</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="num_predicted_correct_prots" type="xs:double" use="required">
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<xs:annotation>
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<xs:documentation>total number of predicted correct protein ids (sum of probabilities)</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="num_input_1_spectra" type="xs:integer" use="required">
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<xs:annotation>
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<xs:documentation>number of spectra from 1+ precursor ions</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="num_input_2_spectra" type="xs:integer" use="required">
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<xs:annotation>
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<xs:documentation>number of spectra from 2+ precursor ions</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="num_input_3_spectra" type="xs:integer" use="required">
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<xs:annotation>
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<xs:documentation>number of spectra from 3+ precursor ions</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="num_input_4_spectra" type="xs:integer" use="required">
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<xs:annotation>
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<xs:documentation>number of spectra from 4+ precursor ions</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="num_input_5_spectra" type="xs:integer" use="required">
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<xs:annotation>
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<xs:documentation>number of spectra from 5+ precursor ions</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="initial_min_peptide_prob" type="xs:double" use="required">
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<xs:annotation>
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<xs:documentation>minimum initial peptide probability to contribute to analysis</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="total_no_spectrum_ids" type="xs:double">
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<xs:annotation>
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<xs:documentation>total estimated number of correct peptide assignments in dataset</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="sample_enzyme" type="xs:string" use="required">
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<xs:annotation>
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<xs:documentation>enzyme applied to sample prior to MS/MS</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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</xs:complexType>
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</xs:element>
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<xs:element name="analysis_summary" minOccurs="0" maxOccurs="unbounded">
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<xs:complexType>
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<xs:sequence>
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<xs:any namespace="##any" processContents="lax" minOccurs="0">
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<xs:annotation>
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<xs:documentation>time of analysis</xs:documentation>
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</xs:annotation>
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</xs:any>
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</xs:sequence>
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<xs:attribute name="analysis" type="xs:string" use="required">
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<xs:annotation>
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<xs:documentation>name of protein-level analysis</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="time" type="xs:dateTime" use="required">
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<xs:annotation>
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<xs:documentation>time of analysis</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="id" type="xs:nonNegativeInteger" use="required">
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<xs:annotation>
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<xs:documentation>unique id corresponding with analysis_result elements</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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</xs:complexType>
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</xs:element>
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<xs:element name="dataset_derivation">
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<xs:annotation>
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<xs:documentation>Source and filtering criteria used to generate dataset</xs:documentation>
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</xs:annotation>
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<xs:complexType>
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<xs:sequence minOccurs="0" maxOccurs="unbounded">
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<xs:element name="data_filter">
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<xs:complexType>
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<xs:attribute name="number" type="xs:string" use="required">
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<xs:annotation>
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<xs:documentation>generation number (0 is root)</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="parent_file" type="xs:string" use="required">
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<xs:annotation>
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<xs:documentation>File from which derived</xs:documentation>
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</xs:annotation>
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</xs:attribute>
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<xs:attribute name="windows_parent" type="xs:string"/>
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<xs:attribute name="description" type="xs:string" use="required">
|
|
268
|
+
<xs:annotation>
|
|
269
|
+
<xs:documentation>filtering criteria applied to data</xs:documentation>
|
|
270
|
+
</xs:annotation>
|
|
271
|
+
</xs:attribute>
|
|
272
|
+
</xs:complexType>
|
|
273
|
+
</xs:element>
|
|
274
|
+
</xs:sequence>
|
|
275
|
+
<xs:attribute name="generation_no" type="xs:string" use="required">
|
|
276
|
+
<xs:annotation>
|
|
277
|
+
<xs:documentation>number preceding filter generations</xs:documentation>
|
|
278
|
+
</xs:annotation>
|
|
279
|
+
</xs:attribute>
|
|
280
|
+
</xs:complexType>
|
|
281
|
+
</xs:element>
|
|
282
|
+
<xs:element name="protein_group" maxOccurs="unbounded">
|
|
283
|
+
<xs:complexType>
|
|
284
|
+
<xs:sequence>
|
|
285
|
+
<xs:element name="protein" maxOccurs="unbounded">
|
|
286
|
+
<xs:complexType>
|
|
287
|
+
<xs:sequence>
|
|
288
|
+
<!-- note: nameValueType defined below -->
|
|
289
|
+
<xs:element name="parameter" type="nameValueType" minOccurs="0" maxOccurs="unbounded"/>
|
|
290
|
+
<xs:element name="analysis_result" minOccurs="0" maxOccurs="unbounded">
|
|
291
|
+
<xs:complexType>
|
|
292
|
+
<xs:sequence>
|
|
293
|
+
<xs:any namespace="##any" processContents="lax">
|
|
294
|
+
<xs:annotation>
|
|
295
|
+
<xs:documentation>wildcard to be substituted with element storing analysis-specific result info</xs:documentation>
|
|
296
|
+
</xs:annotation>
|
|
297
|
+
</xs:any>
|
|
298
|
+
|
|
299
|
+
</xs:sequence>
|
|
300
|
+
<xs:attribute name="analysis" type="xs:string" use="required">
|
|
301
|
+
<xs:annotation>
|
|
302
|
+
<xs:documentation>name of protein level analysis</xs:documentation>
|
|
303
|
+
</xs:annotation>
|
|
304
|
+
</xs:attribute>
|
|
305
|
+
|
|
306
|
+
<xs:attribute name="id" type="xs:nonNegativeInteger" default="1">
|
|
307
|
+
<xs:annotation>
|
|
308
|
+
<xs:documentation>unique identifier to analysis_summary element</xs:documentation>
|
|
309
|
+
</xs:annotation>
|
|
310
|
+
</xs:attribute>
|
|
311
|
+
|
|
312
|
+
</xs:complexType>
|
|
313
|
+
</xs:element>
|
|
314
|
+
<xs:element name="annotation" minOccurs="0">
|
|
315
|
+
<xs:complexType>
|
|
316
|
+
<xs:attribute name="protein_description" type="xs:string" use="required"/>
|
|
317
|
+
<xs:attribute name="ipi_name" type="xs:string"/>
|
|
318
|
+
<xs:attribute name="refseq_name" type="xs:string"/>
|
|
319
|
+
<xs:attribute name="swissprot_name" type="xs:string"/>
|
|
320
|
+
<xs:attribute name="ensembl_name" type="xs:string"/>
|
|
321
|
+
<xs:attribute name="trembl_name" type="xs:string"/>
|
|
322
|
+
<xs:attribute name="locus_link_name" type="xs:string"/>
|
|
323
|
+
<xs:attribute name="flybase" type="xs:string"/>
|
|
324
|
+
</xs:complexType>
|
|
325
|
+
</xs:element>
|
|
326
|
+
<xs:element name="indistinguishable_protein" minOccurs="0" maxOccurs="unbounded">
|
|
327
|
+
<xs:annotation>
|
|
328
|
+
<xs:documentation>other protein sharing corresponding peptides</xs:documentation>
|
|
329
|
+
</xs:annotation>
|
|
330
|
+
<xs:complexType>
|
|
331
|
+
<xs:sequence>
|
|
332
|
+
<!-- note: nameValueType defined below -->
|
|
333
|
+
<xs:element name="parameter" type="nameValueType" minOccurs="0" maxOccurs="unbounded"/>
|
|
334
|
+
<xs:element name="annotation" minOccurs="0">
|
|
335
|
+
<xs:annotation>
|
|
336
|
+
<xs:documentation>protein description</xs:documentation>
|
|
337
|
+
</xs:annotation>
|
|
338
|
+
|
|
339
|
+
<xs:complexType>
|
|
340
|
+
<xs:attribute name="protein_description" type="xs:string" use="required">
|
|
341
|
+
<xs:annotation>
|
|
342
|
+
<xs:documentation>description</xs:documentation>
|
|
343
|
+
</xs:annotation>
|
|
344
|
+
</xs:attribute>
|
|
345
|
+
|
|
346
|
+
<xs:attribute name="ipi_name" type="xs:string"/>
|
|
347
|
+
<xs:attribute name="refseq_name" type="xs:string"/>
|
|
348
|
+
<xs:attribute name="swissprot_name" type="xs:string"/>
|
|
349
|
+
<xs:attribute name="ensembl_name" type="xs:string"/>
|
|
350
|
+
<xs:attribute name="trembl_name" type="xs:string"/>
|
|
351
|
+
<xs:attribute name="locus_link_name" type="xs:string"/>
|
|
352
|
+
<xs:attribute name="flybase" type="xs:string"/>
|
|
353
|
+
</xs:complexType>
|
|
354
|
+
</xs:element>
|
|
355
|
+
</xs:sequence>
|
|
356
|
+
<xs:attribute name="protein_name" type="xs:string" use="required"/>
|
|
357
|
+
</xs:complexType>
|
|
358
|
+
</xs:element>
|
|
359
|
+
<xs:element name="peptide" maxOccurs="unbounded">
|
|
360
|
+
<xs:complexType>
|
|
361
|
+
<xs:sequence>
|
|
362
|
+
<xs:element name="parameter" minOccurs="0" maxOccurs="unbounded">
|
|
363
|
+
<xs:complexType>
|
|
364
|
+
<xs:simpleContent>
|
|
365
|
+
<xs:extension base="xs:anySimpleType">
|
|
366
|
+
<xs:attribute name="name" type="xs:string" use="required"/>
|
|
367
|
+
<xs:attribute name="value" type="xs:anySimpleType" use="required"/>
|
|
368
|
+
<xs:attribute name="type" type="xs:anySimpleType"/>
|
|
369
|
+
</xs:extension>
|
|
370
|
+
</xs:simpleContent>
|
|
371
|
+
</xs:complexType>
|
|
372
|
+
</xs:element>
|
|
373
|
+
<xs:element name="modification_info" minOccurs="0" maxOccurs="unbounded">
|
|
374
|
+
<xs:complexType>
|
|
375
|
+
<xs:sequence>
|
|
376
|
+
<xs:element name="mod_aminoacid_mass" minOccurs="0" maxOccurs="unbounded">
|
|
377
|
+
<xs:complexType>
|
|
378
|
+
<xs:attribute name="position" type="xs:string" use="required"/>
|
|
379
|
+
<xs:attribute name="mass" type="xs:string" use="required"/>
|
|
380
|
+
</xs:complexType>
|
|
381
|
+
</xs:element>
|
|
382
|
+
</xs:sequence>
|
|
383
|
+
<xs:attribute name="mod_nterm_mass" type="xs:string"/>
|
|
384
|
+
<xs:attribute name="mod_cterm_mass" type="xs:string"/>
|
|
385
|
+
<xs:attribute name="modified_peptide" type="xs:string"/>
|
|
386
|
+
</xs:complexType>
|
|
387
|
+
</xs:element>
|
|
388
|
+
<xs:element name="peptide_parent_protein" minOccurs="0" maxOccurs="unbounded">
|
|
389
|
+
<xs:complexType>
|
|
390
|
+
<xs:attribute name="protein_name" type="xs:string" use="required"/>
|
|
391
|
+
</xs:complexType>
|
|
392
|
+
</xs:element>
|
|
393
|
+
<xs:element name="indistinguishable_peptide" minOccurs="0" maxOccurs="unbounded">
|
|
394
|
+
<xs:complexType>
|
|
395
|
+
<xs:sequence>
|
|
396
|
+
<xs:element name="modification_info" minOccurs="0" maxOccurs="unbounded">
|
|
397
|
+
<xs:complexType>
|
|
398
|
+
<xs:sequence>
|
|
399
|
+
<xs:element name="mod_aminoacid_mass" minOccurs="0" maxOccurs="unbounded">
|
|
400
|
+
<xs:complexType>
|
|
401
|
+
<xs:attribute name="position" type="xs:string" use="required"/>
|
|
402
|
+
<xs:attribute name="mass" type="xs:string" use="required"/>
|
|
403
|
+
</xs:complexType>
|
|
404
|
+
</xs:element>
|
|
405
|
+
</xs:sequence>
|
|
406
|
+
<xs:attribute name="mod_nterm_mass" type="xs:string"/>
|
|
407
|
+
<xs:attribute name="mod_cterm_mass" type="xs:string"/>
|
|
408
|
+
<xs:attribute name="modified_peptide" type="xs:string"/>
|
|
409
|
+
<xs:attribute name="calc_neutral_pep_mass" type="xs:double" use="optional" />
|
|
410
|
+
</xs:complexType>
|
|
411
|
+
</xs:element>
|
|
412
|
+
</xs:sequence>
|
|
413
|
+
<xs:attribute name="peptide_sequence" type="xs:string" use="required"/>
|
|
414
|
+
</xs:complexType>
|
|
415
|
+
</xs:element>
|
|
416
|
+
</xs:sequence>
|
|
417
|
+
<xs:attribute name="peptide_sequence" type="xs:string" use="required">
|
|
418
|
+
<xs:annotation>
|
|
419
|
+
<xs:documentation>unmodified aa sequence</xs:documentation>
|
|
420
|
+
</xs:annotation>
|
|
421
|
+
</xs:attribute>
|
|
422
|
+
|
|
423
|
+
<xs:attribute name="charge" type="xs:positiveInteger" use="required">
|
|
424
|
+
<xs:annotation>
|
|
425
|
+
<xs:documentation>precursor ion charge</xs:documentation>
|
|
426
|
+
</xs:annotation>
|
|
427
|
+
</xs:attribute>
|
|
428
|
+
|
|
429
|
+
<xs:attribute name="initial_probability" type="xs:double" use="required">
|
|
430
|
+
<xs:annotation>
|
|
431
|
+
<xs:documentation>prior to nsp adjustment</xs:documentation>
|
|
432
|
+
</xs:annotation>
|
|
433
|
+
</xs:attribute>
|
|
434
|
+
|
|
435
|
+
<xs:attribute name="nsp_adjusted_probability" type="xs:double" use="optional">
|
|
436
|
+
<xs:annotation>
|
|
437
|
+
<xs:documentation>after nsp adjustment</xs:documentation>
|
|
438
|
+
</xs:annotation>
|
|
439
|
+
</xs:attribute>
|
|
440
|
+
|
|
441
|
+
<xs:attribute name="ni_adjusted_probability" type="xs:double" use="optional">
|
|
442
|
+
<xs:annotation>
|
|
443
|
+
<xs:documentation>after ni adjustment</xs:documentation>
|
|
444
|
+
</xs:annotation>
|
|
445
|
+
</xs:attribute>
|
|
446
|
+
|
|
447
|
+
<xs:attribute name="exp_sibling_ion_instances" type="xs:double" use="optional">
|
|
448
|
+
<xs:annotation>
|
|
449
|
+
<xs:documentation>expected sibling ion instances</xs:documentation>
|
|
450
|
+
</xs:annotation>
|
|
451
|
+
</xs:attribute>
|
|
452
|
+
|
|
453
|
+
<xs:attribute name="exp_sibling_ion_bin" type="xs:double" use="optional">
|
|
454
|
+
<xs:annotation>
|
|
455
|
+
<xs:documentation>expected sibling ion bin</xs:documentation>
|
|
456
|
+
</xs:annotation>
|
|
457
|
+
</xs:attribute>
|
|
458
|
+
|
|
459
|
+
<xs:attribute name="exp_tot_instances" type="xs:double" use="optional">
|
|
460
|
+
<xs:annotation>
|
|
461
|
+
<xs:documentation>expected total instances</xs:documentation>
|
|
462
|
+
</xs:annotation>
|
|
463
|
+
</xs:attribute>
|
|
464
|
+
|
|
465
|
+
<xs:attribute name="peptide_group_designator" type="xs:string">
|
|
466
|
+
<xs:annotation>
|
|
467
|
+
<xs:documentation>link to spectra with other precursor ion charges assigned to same peptide</xs:documentation>
|
|
468
|
+
</xs:annotation>
|
|
469
|
+
</xs:attribute>
|
|
470
|
+
|
|
471
|
+
<xs:attribute name="weight" type="xs:double" default="1.0"/>
|
|
472
|
+
<xs:attribute name="is_nondegenerate_evidence" type="xs:string" use="required">
|
|
473
|
+
<xs:annotation>
|
|
474
|
+
<xs:documentation>confidence that peptide corresponds with this protein (rather than others in which it occurs)</xs:documentation>
|
|
475
|
+
</xs:annotation>
|
|
476
|
+
</xs:attribute>
|
|
477
|
+
|
|
478
|
+
<xs:attribute name="n_enzymatic_termini" type="xs:nonNegativeInteger" use="required">
|
|
479
|
+
<xs:annotation>
|
|
480
|
+
<xs:documentation>number of termini consistent with proteolytic cleavage</xs:documentation>
|
|
481
|
+
</xs:annotation>
|
|
482
|
+
</xs:attribute>
|
|
483
|
+
|
|
484
|
+
<xs:attribute name="n_sibling_peptides" type="xs:double">
|
|
485
|
+
<xs:annotation>
|
|
486
|
+
<xs:documentation>estimated number of sibling peptides (other identified peptides corresponding to same protein)</xs:documentation>
|
|
487
|
+
</xs:annotation>
|
|
488
|
+
</xs:attribute>
|
|
489
|
+
|
|
490
|
+
<xs:attribute name="n_sibling_peptides_bin" type="xs:integer" default="0">
|
|
491
|
+
<xs:annotation>
|
|
492
|
+
<xs:documentation>discretized nsp value</xs:documentation>
|
|
493
|
+
</xs:annotation>
|
|
494
|
+
</xs:attribute>
|
|
495
|
+
|
|
496
|
+
<xs:attribute name="n_instances" type="xs:integer" use="required">
|
|
497
|
+
<xs:annotation>
|
|
498
|
+
<xs:documentation>number of times peptide assigned to spectrum of precursor ion charge in dataset</xs:documentation>
|
|
499
|
+
</xs:annotation>
|
|
500
|
+
</xs:attribute>
|
|
501
|
+
|
|
502
|
+
<xs:attribute name="calc_neutral_pep_mass" type="xs:double"/>
|
|
503
|
+
<xs:attribute name="is_contributing_evidence" type="xs:string" use="required"/>
|
|
504
|
+
</xs:complexType>
|
|
505
|
+
</xs:element>
|
|
506
|
+
</xs:sequence>
|
|
507
|
+
<xs:attribute name="protein_name" type="xs:string" use="required">
|
|
508
|
+
<xs:annotation>
|
|
509
|
+
<xs:documentation>database protein name</xs:documentation>
|
|
510
|
+
</xs:annotation>
|
|
511
|
+
</xs:attribute>
|
|
512
|
+
|
|
513
|
+
<xs:attribute name="probability" type="xs:double" use="required">
|
|
514
|
+
<xs:annotation>
|
|
515
|
+
<xs:documentation>confidence of protein id</xs:documentation>
|
|
516
|
+
</xs:annotation>
|
|
517
|
+
</xs:attribute>
|
|
518
|
+
<xs:attribute name="percent_coverage" type="xs:double">
|
|
519
|
+
<xs:annotation>
|
|
520
|
+
<xs:documentation>percent of protein sequence covered by corresponding peptides</xs:documentation>
|
|
521
|
+
</xs:annotation>
|
|
522
|
+
</xs:attribute>
|
|
523
|
+
<xs:attribute name="n_indistinguishable_proteins" type="xs:integer" use="required">
|
|
524
|
+
<xs:annotation>
|
|
525
|
+
<xs:documentation>number of proteins with identical corresponding peptides</xs:documentation>
|
|
526
|
+
</xs:annotation>
|
|
527
|
+
</xs:attribute>
|
|
528
|
+
<xs:attribute name="unique_stripped_peptides" type="xs:string"/>
|
|
529
|
+
<xs:attribute name="group_sibling_id" type="xs:string" use="required">
|
|
530
|
+
<xs:annotation>
|
|
531
|
+
<xs:documentation>protein group id</xs:documentation>
|
|
532
|
+
</xs:annotation>
|
|
533
|
+
</xs:attribute>
|
|
534
|
+
<xs:attribute name="total_number_peptides" type="xs:integer">
|
|
535
|
+
<xs:annotation>
|
|
536
|
+
<xs:documentation>total number of corresponding peptides that contributed to protein probability</xs:documentation>
|
|
537
|
+
</xs:annotation>
|
|
538
|
+
</xs:attribute>
|
|
539
|
+
<xs:attribute name="subsuming_protein_entry" type="xs:string">
|
|
540
|
+
<xs:annotation>
|
|
541
|
+
<xs:documentation>name of portein containing all corresponding peptides, and more</xs:documentation>
|
|
542
|
+
</xs:annotation>
|
|
543
|
+
</xs:attribute>
|
|
544
|
+
<xs:attribute name="pct_spectrum_ids" type="xs:string">
|
|
545
|
+
<xs:annotation>
|
|
546
|
+
<xs:documentation>fraction of correct dataset peptide identifications corresponding to protein</xs:documentation>
|
|
547
|
+
</xs:annotation>
|
|
548
|
+
</xs:attribute>
|
|
549
|
+
</xs:complexType>
|
|
550
|
+
<xs:unique name="unique_result_analysis_id">
|
|
551
|
+
<xs:annotation>
|
|
552
|
+
<xs:documentation>can only have one analysis/id combination within each protein element</xs:documentation>
|
|
553
|
+
</xs:annotation>
|
|
554
|
+
|
|
555
|
+
<xs:selector xpath="./protx:analysis_result"/>
|
|
556
|
+
<xs:field xpath="@analysis"/>
|
|
557
|
+
<xs:field xpath="@id"/>
|
|
558
|
+
</xs:unique>
|
|
559
|
+
</xs:element>
|
|
560
|
+
</xs:sequence>
|
|
561
|
+
<xs:attribute name="group_number" type="xs:string" use="required">
|
|
562
|
+
<xs:annotation>
|
|
563
|
+
<xs:documentation>index</xs:documentation>
|
|
564
|
+
</xs:annotation>
|
|
565
|
+
</xs:attribute>
|
|
566
|
+
<xs:attribute name="pseudo_name" type="xs:string"/>
|
|
567
|
+
<xs:attribute name="probability" type="xs:double" use="required">
|
|
568
|
+
<xs:annotation>
|
|
569
|
+
<xs:documentation>group probability (taking contributions from all group member proteins)</xs:documentation>
|
|
570
|
+
</xs:annotation>
|
|
571
|
+
</xs:attribute>
|
|
572
|
+
</xs:complexType>
|
|
573
|
+
<xs:unique name="unique_group_sibling_id">
|
|
574
|
+
<xs:annotation>
|
|
575
|
+
<xs:documentation>Each group_sibling_id must be unique within a protein group</xs:documentation>
|
|
576
|
+
</xs:annotation>
|
|
577
|
+
<xs:selector xpath="./protx:protein"/>
|
|
578
|
+
<xs:field xpath="@group_sibling_id"/>
|
|
579
|
+
</xs:unique>
|
|
580
|
+
|
|
581
|
+
</xs:element>
|
|
582
|
+
</xs:sequence>
|
|
583
|
+
<xs:attribute name="summary_xml" type="xs:string"/>
|
|
584
|
+
</xs:complexType>
|
|
585
|
+
<xs:key name="summary_analysis_id">
|
|
586
|
+
<xs:selector xpath="./protx:analysis_summary"/>
|
|
587
|
+
<xs:field xpath="@analysis"/>
|
|
588
|
+
<xs:field xpath="@id"/>
|
|
589
|
+
</xs:key>
|
|
590
|
+
<xs:keyref name="result_analysis_id" refer="summary_analysis_id">
|
|
591
|
+
<xs:annotation>
|
|
592
|
+
<xs:documentation>analysis and id must correspond with those fields in an analysis_summary element</xs:documentation>
|
|
593
|
+
</xs:annotation>
|
|
594
|
+
<xs:selector xpath="./protx:protein_group/protx:protein/protx:analysis_result"/>
|
|
595
|
+
<xs:field xpath="@analysis"/>
|
|
596
|
+
<xs:field xpath="@id"/>
|
|
597
|
+
</xs:keyref>
|
|
598
|
+
<xs:unique name="unique_group_number">
|
|
599
|
+
<xs:annotation>
|
|
600
|
+
<xs:documentation>Requires group numbers be unique for entire dataset</xs:documentation>
|
|
601
|
+
</xs:annotation>
|
|
602
|
+
<xs:selector xpath="./protx:protein_group"/>
|
|
603
|
+
<xs:field xpath="@group_number"/>
|
|
604
|
+
</xs:unique>
|
|
605
|
+
</xs:element>
|
|
606
|
+
<xs:element name="proteinprophet_details">
|
|
607
|
+
<xs:annotation>
|
|
608
|
+
<xs:documentation>ProteinProphet analysis details</xs:documentation>
|
|
609
|
+
</xs:annotation>
|
|
610
|
+
<xs:complexType>
|
|
611
|
+
<xs:sequence>
|
|
612
|
+
<xs:element name="nsp_information">
|
|
613
|
+
<xs:annotation>
|
|
614
|
+
<xs:documentation>learned distributions of estimated number of sibling peptides</xs:documentation>
|
|
615
|
+
</xs:annotation>
|
|
616
|
+
<xs:complexType>
|
|
617
|
+
<xs:sequence>
|
|
618
|
+
<xs:element name="nsp_distribution" maxOccurs="unbounded">
|
|
619
|
+
<xs:annotation>
|
|
620
|
+
<xs:documentation>histogram slice of estimated number of sibling peptides</xs:documentation>
|
|
621
|
+
</xs:annotation>
|
|
622
|
+
<xs:complexType>
|
|
623
|
+
<xs:attribute name="bin_no" type="xs:integer" use="required">
|
|
624
|
+
<xs:annotation>
|
|
625
|
+
<xs:documentation>discretized bin number</xs:documentation>
|
|
626
|
+
</xs:annotation>
|
|
627
|
+
</xs:attribute>
|
|
628
|
+
<xs:attribute name="nsp_lower_bound_incl" type="xs:double" use="optional">
|
|
629
|
+
<xs:annotation>
|
|
630
|
+
<xs:documentation>lower bound nsp value (inclusive)</xs:documentation>
|
|
631
|
+
</xs:annotation>
|
|
632
|
+
</xs:attribute>
|
|
633
|
+
<xs:attribute name="nsp_upper_bound_excl" type="xs:string" use="optional">
|
|
634
|
+
<xs:annotation>
|
|
635
|
+
<xs:documentation>upper bound nsp value (exclusive)</xs:documentation>
|
|
636
|
+
</xs:annotation>
|
|
637
|
+
</xs:attribute>
|
|
638
|
+
<xs:attribute name="nsp_lower_bound_excl" type="xs:double" use="optional">
|
|
639
|
+
<xs:annotation>
|
|
640
|
+
<xs:documentation>lower bound nsp value (exclusive)</xs:documentation>
|
|
641
|
+
</xs:annotation>
|
|
642
|
+
</xs:attribute>
|
|
643
|
+
<xs:attribute name="nsp_upper_bound_incl" type="xs:string" use="optional">
|
|
644
|
+
<xs:annotation>
|
|
645
|
+
<xs:documentation>upper bound nsp value (inclusive)</xs:documentation>
|
|
646
|
+
</xs:annotation>
|
|
647
|
+
</xs:attribute>
|
|
648
|
+
<xs:attribute name="pos_freq" type="xs:double" use="required">
|
|
649
|
+
<xs:annotation>
|
|
650
|
+
<xs:documentation>fraction of correct peptides in bin</xs:documentation>
|
|
651
|
+
</xs:annotation>
|
|
652
|
+
</xs:attribute>
|
|
653
|
+
<xs:attribute name="neg_freq" type="xs:double" use="required">
|
|
654
|
+
<xs:annotation>
|
|
655
|
+
<xs:documentation>fraction of incorrect peptides in bin</xs:documentation>
|
|
656
|
+
</xs:annotation>
|
|
657
|
+
</xs:attribute>
|
|
658
|
+
<xs:attribute name="pos_to_neg_ratio" type="xs:double" use="required">
|
|
659
|
+
<xs:annotation>
|
|
660
|
+
<xs:documentation>fraction of correct / fraction of incorrect</xs:documentation>
|
|
661
|
+
</xs:annotation>
|
|
662
|
+
</xs:attribute>
|
|
663
|
+
<xs:attribute name="alt_pos_to_neg_ratio" type="xs:double">
|
|
664
|
+
<xs:annotation>
|
|
665
|
+
<xs:documentation>pos_to_neg_ratio of preceding bin (if greater than that of current bin)</xs:documentation>
|
|
666
|
+
</xs:annotation>
|
|
667
|
+
</xs:attribute>
|
|
668
|
+
</xs:complexType>
|
|
669
|
+
</xs:element>
|
|
670
|
+
</xs:sequence>
|
|
671
|
+
<xs:attribute name="neighboring_bin_smoothing" type="xs:string" use="required"/>
|
|
672
|
+
</xs:complexType>
|
|
673
|
+
</xs:element>
|
|
674
|
+
<xs:element name="ni_information">
|
|
675
|
+
<xs:annotation>
|
|
676
|
+
<xs:documentation>learned distributions of estimated number of peptide instances ("number of instances")</xs:documentation>
|
|
677
|
+
</xs:annotation>
|
|
678
|
+
<xs:complexType>
|
|
679
|
+
<xs:sequence>
|
|
680
|
+
<xs:element name="ni_distribution" maxOccurs="unbounded">
|
|
681
|
+
<xs:annotation>
|
|
682
|
+
<xs:documentation>histogram slice of estimated number of sibling peptides</xs:documentation>
|
|
683
|
+
</xs:annotation>
|
|
684
|
+
<xs:complexType>
|
|
685
|
+
<xs:attribute name="bin_no" type="xs:integer" use="required">
|
|
686
|
+
<xs:annotation>
|
|
687
|
+
<xs:documentation>discretized bin number</xs:documentation>
|
|
688
|
+
</xs:annotation>
|
|
689
|
+
</xs:attribute>
|
|
690
|
+
<xs:attribute name="ni_lower_bound_incl" type="xs:double" use="optional">
|
|
691
|
+
<xs:annotation>
|
|
692
|
+
<xs:documentation>lower bound nsp value (inclusive)</xs:documentation>
|
|
693
|
+
</xs:annotation>
|
|
694
|
+
</xs:attribute>
|
|
695
|
+
<xs:attribute name="ni_upper_bound_excl" type="xs:string" use="optional">
|
|
696
|
+
<xs:annotation>
|
|
697
|
+
<xs:documentation>upper bound nsp value (exclusive)</xs:documentation>
|
|
698
|
+
</xs:annotation>
|
|
699
|
+
</xs:attribute>
|
|
700
|
+
<xs:attribute name="ni_lower_bound_excl" type="xs:double" use="optional">
|
|
701
|
+
<xs:annotation>
|
|
702
|
+
<xs:documentation>lower bound nsp value (exclusive)</xs:documentation>
|
|
703
|
+
</xs:annotation>
|
|
704
|
+
</xs:attribute>
|
|
705
|
+
<xs:attribute name="ni_upper_bound_incl" type="xs:string" use="optional">
|
|
706
|
+
<xs:annotation>
|
|
707
|
+
<xs:documentation>upper bound nsp value (inclusive)</xs:documentation>
|
|
708
|
+
</xs:annotation>
|
|
709
|
+
</xs:attribute>
|
|
710
|
+
<xs:attribute name="pos_freq" type="xs:double" use="required">
|
|
711
|
+
<xs:annotation>
|
|
712
|
+
<xs:documentation>fraction of correct peptides in bin</xs:documentation>
|
|
713
|
+
</xs:annotation>
|
|
714
|
+
</xs:attribute>
|
|
715
|
+
<xs:attribute name="neg_freq" type="xs:double" use="required">
|
|
716
|
+
<xs:annotation>
|
|
717
|
+
<xs:documentation>fraction of incorrect peptides in bin</xs:documentation>
|
|
718
|
+
</xs:annotation>
|
|
719
|
+
</xs:attribute>
|
|
720
|
+
<xs:attribute name="pos_to_neg_ratio" type="xs:double" use="required">
|
|
721
|
+
<xs:annotation>
|
|
722
|
+
<xs:documentation>fraction of correct / fraction of incorrect</xs:documentation>
|
|
723
|
+
</xs:annotation>
|
|
724
|
+
</xs:attribute>
|
|
725
|
+
<xs:attribute name="alt_pos_to_neg_ratio" type="xs:double">
|
|
726
|
+
<xs:annotation>
|
|
727
|
+
<xs:documentation>pos_to_neg_ratio of preceding bin (if greater than that of current bin)</xs:documentation>
|
|
728
|
+
</xs:annotation>
|
|
729
|
+
</xs:attribute>
|
|
730
|
+
</xs:complexType>
|
|
731
|
+
</xs:element>
|
|
732
|
+
</xs:sequence>
|
|
733
|
+
<!--
|
|
734
|
+
<xs:attribute name="neighboring_bin_smoothing" type="xs:string" use="required"/>
|
|
735
|
+
-->
|
|
736
|
+
</xs:complexType>
|
|
737
|
+
</xs:element>
|
|
738
|
+
<xs:element name="protein_summary_data_filter" maxOccurs="unbounded">
|
|
739
|
+
<xs:annotation>
|
|
740
|
+
<xs:documentation>predicted error/sensitivity for filtering at minimum probability</xs:documentation>
|
|
741
|
+
</xs:annotation>
|
|
742
|
+
<xs:complexType>
|
|
743
|
+
<xs:attribute name="min_probability" type="xs:double" use="required">
|
|
744
|
+
<xs:annotation>
|
|
745
|
+
<xs:documentation>filter setting</xs:documentation>
|
|
746
|
+
</xs:annotation>
|
|
747
|
+
</xs:attribute>
|
|
748
|
+
<xs:attribute name="sensitivity" type="xs:double" use="required">
|
|
749
|
+
<xs:annotation>
|
|
750
|
+
<xs:documentation>predicted sensitivity (fraction of correct results passing filter)</xs:documentation>
|
|
751
|
+
</xs:annotation>
|
|
752
|
+
</xs:attribute>
|
|
753
|
+
<xs:attribute name="false_positive_error_rate" type="xs:double" use="required">
|
|
754
|
+
<xs:annotation>
|
|
755
|
+
<xs:documentation>predicted error rate (fraction of results passing filter than are incorrect)</xs:documentation>
|
|
756
|
+
</xs:annotation>
|
|
757
|
+
</xs:attribute>
|
|
758
|
+
<xs:attribute name="predicted_num_correct" type="xs:double">
|
|
759
|
+
<xs:annotation>
|
|
760
|
+
<xs:documentation>predicted number of correct results passing filter</xs:documentation>
|
|
761
|
+
</xs:annotation>
|
|
762
|
+
</xs:attribute>
|
|
763
|
+
<xs:attribute name="predicted_num_incorrect" type="xs:double">
|
|
764
|
+
<xs:annotation>
|
|
765
|
+
<xs:documentation>predicted number of incorrect results passing filter</xs:documentation>
|
|
766
|
+
</xs:annotation>
|
|
767
|
+
</xs:attribute>
|
|
768
|
+
</xs:complexType>
|
|
769
|
+
</xs:element>
|
|
770
|
+
</xs:sequence>
|
|
771
|
+
<xs:attribute name="occam_flag" type="xs:string" use="required">
|
|
772
|
+
<xs:annotation>
|
|
773
|
+
<xs:documentation>whether or not occams razor was used to apportion peptides corresponding to multiple proteins</xs:documentation>
|
|
774
|
+
</xs:annotation>
|
|
775
|
+
</xs:attribute>
|
|
776
|
+
<xs:attribute name="groups_flag" type="xs:string" use="required">
|
|
777
|
+
<xs:annotation>
|
|
778
|
+
<xs:documentation>whether or not related proteins are organized together in common protein groups</xs:documentation>
|
|
779
|
+
</xs:annotation>
|
|
780
|
+
</xs:attribute>
|
|
781
|
+
<xs:attribute name="degen_flag" type="xs:string" use="required">
|
|
782
|
+
<xs:annotation>
|
|
783
|
+
<xs:documentation>whether or not all proteins corresponding to each identified peptide were used in analysis</xs:documentation>
|
|
784
|
+
</xs:annotation>
|
|
785
|
+
</xs:attribute>
|
|
786
|
+
<xs:attribute name="nsp_flag" type="xs:string" use="required">
|
|
787
|
+
<xs:annotation>
|
|
788
|
+
<xs:documentation>whether or not peptide probabilities were adjusted for estimated number of sibling peptides</xs:documentation>
|
|
789
|
+
</xs:annotation>
|
|
790
|
+
</xs:attribute>
|
|
791
|
+
<xs:attribute name="initial_peptide_wt_iters" type="xs:string" use="required">
|
|
792
|
+
<xs:annotation>
|
|
793
|
+
<xs:documentation>proteinprophet number of initial iterations to compute peptide weights</xs:documentation>
|
|
794
|
+
</xs:annotation>
|
|
795
|
+
</xs:attribute>
|
|
796
|
+
<xs:attribute name="nsp_distribution_iters" type="xs:string" use="required">
|
|
797
|
+
<xs:annotation>
|
|
798
|
+
<xs:documentation>proteinprophet number of interations used to compute nsp distributions</xs:documentation>
|
|
799
|
+
</xs:annotation>
|
|
800
|
+
</xs:attribute>
|
|
801
|
+
<xs:attribute name="final_peptide_wt_iters" type="xs:string" use="required">
|
|
802
|
+
<xs:annotation>
|
|
803
|
+
<xs:documentation>proteinprophet number of final interations used to compute final peptide weights</xs:documentation>
|
|
804
|
+
</xs:annotation>
|
|
805
|
+
</xs:attribute>
|
|
806
|
+
<xs:attribute name="run_options" type="xs:string">
|
|
807
|
+
<xs:annotation>
|
|
808
|
+
<xs:documentation>special run options</xs:documentation>
|
|
809
|
+
</xs:annotation>
|
|
810
|
+
</xs:attribute>
|
|
811
|
+
</xs:complexType>
|
|
812
|
+
</xs:element>
|
|
813
|
+
<xs:element name="XPress_analysis_summary">
|
|
814
|
+
<xs:complexType>
|
|
815
|
+
<xs:attribute name="min_peptide_probability" type="xs:double" use="required"/>
|
|
816
|
+
<xs:attribute name="min_peptide_weight" type="xs:double" use="required"/>
|
|
817
|
+
<xs:attribute name="min_protein_probability" type="xs:double" use="required"/>
|
|
818
|
+
<xs:attribute name="reference_isotope" type="xs:string"/>
|
|
819
|
+
</xs:complexType>
|
|
820
|
+
</xs:element>
|
|
821
|
+
<xs:element name="ASAP_prot_analysis_summary">
|
|
822
|
+
<xs:complexType>
|
|
823
|
+
<xs:attribute name="version" type="xs:string"/>
|
|
824
|
+
<xs:attribute name="binary_ref_files" type="xs:string"/>
|
|
825
|
+
<xs:attribute name="min_peptide_probability" type="xs:double" use="required"/>
|
|
826
|
+
<xs:attribute name="min_peptide_weight" type="xs:double" use="required"/>
|
|
827
|
+
<xs:attribute name="min_protein_probability" type="xs:double" use="required"/>
|
|
828
|
+
<xs:attribute name="reference_isotope" type="xs:string"/>
|
|
829
|
+
</xs:complexType>
|
|
830
|
+
</xs:element>
|
|
831
|
+
<xs:element name="ASAP_pvalue_analysis_summary">
|
|
832
|
+
<xs:complexType>
|
|
833
|
+
<xs:attribute name="asapratio_id" type="xs:nonNegativeInteger" default="1"/>
|
|
834
|
+
<xs:attribute name="background_ratio_mean" type="xs:double" use="required"/>
|
|
835
|
+
<xs:attribute name="background_ratio_stdev" type="xs:double" use="required"/>
|
|
836
|
+
<xs:attribute name="background_fitting_error" type="xs:double" use="required"/>
|
|
837
|
+
<xs:attribute name="analysis_distribution_file" type="xs:string" use="required"/>
|
|
838
|
+
<xs:attribute name="full_analysis_distr_file" type="xs:string"/>
|
|
839
|
+
<xs:attribute name="asap_prot_id" type="xs:nonNegativeInteger" default="1"/>
|
|
840
|
+
</xs:complexType>
|
|
841
|
+
</xs:element>
|
|
842
|
+
|
|
843
|
+
|
|
844
|
+
<xs:simpleType name="positiveInt">
|
|
845
|
+
<xs:restriction base="xs:unsignedInt">
|
|
846
|
+
<xs:minInclusive value="1"/>
|
|
847
|
+
</xs:restriction>
|
|
848
|
+
</xs:simpleType>
|
|
849
|
+
<xs:element name="libra_result">
|
|
850
|
+
<xs:complexType>
|
|
851
|
+
<xs:sequence>
|
|
852
|
+
<xs:element name="intensity" maxOccurs="unbounded">
|
|
853
|
+
<xs:complexType>
|
|
854
|
+
<xs:attribute name="mz" type="xs:float" use="required"/>
|
|
855
|
+
<xs:attribute name="ratio" type="xs:float" use="required"/>
|
|
856
|
+
<xs:attribute name="error" type="xs:float" use="required"/>
|
|
857
|
+
</xs:complexType>
|
|
858
|
+
</xs:element>
|
|
859
|
+
</xs:sequence>
|
|
860
|
+
<xs:attribute name="number" type="xs:nonNegativeInteger" use="required"/>
|
|
861
|
+
</xs:complexType>
|
|
862
|
+
<xs:unique name="libra_result_channel_index">
|
|
863
|
+
<xs:selector xpath="."/>
|
|
864
|
+
<xs:field xpath="@channel"/>
|
|
865
|
+
</xs:unique>
|
|
866
|
+
|
|
867
|
+
|
|
868
|
+
</xs:element>
|
|
869
|
+
<xs:element name="libra_summary">
|
|
870
|
+
<xs:complexType>
|
|
871
|
+
<xs:sequence>
|
|
872
|
+
<xs:element name="fragment_masses" maxOccurs="unbounded">
|
|
873
|
+
<xs:complexType>
|
|
874
|
+
<xs:attribute name="channel" type="positiveInt" use="required"/>
|
|
875
|
+
<xs:attribute name="mz" type="xs:float" use="required"/>
|
|
876
|
+
</xs:complexType>
|
|
877
|
+
</xs:element>
|
|
878
|
+
<xs:element name="isotopic_contributions" minOccurs="0">
|
|
879
|
+
<xs:complexType>
|
|
880
|
+
<xs:sequence>
|
|
881
|
+
<xs:element name="contributing_channel" maxOccurs="unbounded">
|
|
882
|
+
<xs:complexType>
|
|
883
|
+
<xs:sequence>
|
|
884
|
+
<xs:element name="affected_channel" maxOccurs="unbounded">
|
|
885
|
+
<xs:complexType>
|
|
886
|
+
<xs:attribute name="channel" type="positiveInt" use="required"/>
|
|
887
|
+
<xs:attribute name="correction" type="xs:float" use="required"/>
|
|
888
|
+
</xs:complexType>
|
|
889
|
+
</xs:element>
|
|
890
|
+
</xs:sequence>
|
|
891
|
+
<xs:attribute name="channel" type="positiveInt" use="required"/>
|
|
892
|
+
</xs:complexType>
|
|
893
|
+
</xs:element>
|
|
894
|
+
</xs:sequence>
|
|
895
|
+
</xs:complexType>
|
|
896
|
+
</xs:element>
|
|
897
|
+
</xs:sequence>
|
|
898
|
+
<xs:attribute name="mass_tolerance" type="xs:float" use="required"/>
|
|
899
|
+
<xs:attribute name="centroiding_preference" type="xs:int" use="required"/>
|
|
900
|
+
<xs:attribute name="normalization" type="xs:int" use="required"/>
|
|
901
|
+
<xs:attribute name="output_type" type="xs:int" use="required"/>
|
|
902
|
+
<xs:attribute name="channel_code" type="xs:string"/>
|
|
903
|
+
<xs:attribute name="min_pep_prob" type="xs:float" use="required"/>
|
|
904
|
+
<xs:attribute name="min_pep_wt" type="xs:float" use="required"/>
|
|
905
|
+
<xs:attribute name="min_prot_prob" type="xs:float" use="required"/>
|
|
906
|
+
</xs:complexType>
|
|
907
|
+
|
|
908
|
+
<xs:key name="libra_channel_index">
|
|
909
|
+
<xs:selector xpath="./protx:fragment_masses"/>
|
|
910
|
+
<xs:field xpath="@channel"/>
|
|
911
|
+
</xs:key>
|
|
912
|
+
<xs:keyref name="libra_contr_channel_index_ref" refer="libra_channel_index">
|
|
913
|
+
<xs:selector xpath="./protx:isotopic_contributions/protx:contributing_channel"/>
|
|
914
|
+
<xs:field xpath="@channel"/>
|
|
915
|
+
</xs:keyref>
|
|
916
|
+
<xs:keyref name="libra_aff_channel_index_ref" refer="libra_channel_index">
|
|
917
|
+
<xs:selector xpath="./protx:isotopic_contributions/protx:contributing_channel/protx:affected_channel"/>
|
|
918
|
+
<xs:field xpath="@channel"/>
|
|
919
|
+
</xs:keyref>
|
|
920
|
+
|
|
921
|
+
</xs:element>
|
|
922
|
+
|
|
923
|
+
<!-- a loosely-defined, general-purpose type used in the "parameter" element, defined above -->
|
|
924
|
+
<xs:complexType name="nameValueType">
|
|
925
|
+
<xs:simpleContent>
|
|
926
|
+
<xs:extension base="xs:anySimpleType">
|
|
927
|
+
<xs:attribute name="name" type="xs:string" use="required"/>
|
|
928
|
+
<xs:attribute name="value" type="xs:anySimpleType" use="required"/>
|
|
929
|
+
<xs:attribute name="type" type="xs:anySimpleType"/>
|
|
930
|
+
</xs:extension>
|
|
931
|
+
</xs:simpleContent>
|
|
932
|
+
</xs:complexType>
|
|
933
|
+
|
|
934
|
+
|
|
935
|
+
</xs:schema>
|