From 238cd7988ac46d35f4840f047655980382199fa3 Mon Sep 17 00:00:00 2001
From: Zhiyu <zhiyu.zhao@utsouthwestern.edu>
Date: Wed, 1 May 2024 22:02:43 -0500
Subject: [PATCH] 05012024
---
Change_Log.txt | 22 ------------------
{V2.0d_test => V2.1}/CRI_HMDB_KEGG_IDs.xlsx | Bin
.../customized_DB_example_HMDB.csv | 0
.../customized_DB_example_KEGG.csv | 0
.../customized_DB_example_Name.csv | 0
.../reference_metabolites_example_HMDB.txt | 0
.../reference_metabolites_example_KEGG.txt | 0
.../reference_metabolites_example_Name.txt | 0
{V2.0d_test => V2.1}/ODA/MetaboAnalyst.R | 0
.../MetaboAnalyst_3.0.3/All_generic_utils.R | 0
.../MetaboAnalyst_3.0.3/batch_effect_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/biomarker_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/data_trimming.R | 0
.../dependencies_function_imported.R | 0
.../ODA/MetaboAnalyst_3.0.3/enrich_graphics.R | 0
.../ODA/MetaboAnalyst_3.0.3/enrich_integ.R | 0
.../ODA/MetaboAnalyst_3.0.3/enrich_mset.R | 0
.../MetaboAnalyst_3.0.3/enrich_name_match.R | 0
.../enrich_path_graphics.R | 0
.../MetaboAnalyst_3.0.3/enrich_path_stats.R | 0
.../ODA/MetaboAnalyst_3.0.3/enrich_stats.R | 0
.../ODA/MetaboAnalyst_3.0.3/gene_fun_utils.R | 0
.../MetaboAnalyst_3.0.3/general_anot_utils.R | 0
.../MetaboAnalyst_3.0.3/general_data_utils.R | 0
.../MetaboAnalyst_3.0.3/general_lib_utils.R | 0
.../MetaboAnalyst_3.0.3/general_load_libs.R | 0
.../MetaboAnalyst_3.0.3/general_misc_utils.R | 0
.../MetaboAnalyst_3.0.3/general_norm_utils.R | 0
.../MetaboAnalyst_3.0.3/general_proc_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/generic_c_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/meta_data_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/meta_methods.R | 0
.../ODA/MetaboAnalyst_3.0.3/meta_pathway.R | 0
.../misc_effect_size_functions.R | 0
.../ODA/MetaboAnalyst_3.0.3/networks_data.R | 0
.../ODA/MetaboAnalyst_3.0.3/networks_enrich.R | 0
.../ODA/MetaboAnalyst_3.0.3/networks_view.R | 0
.../ODA/MetaboAnalyst_3.0.3/others_lipomics.R | 0
.../ODA/MetaboAnalyst_3.0.3/parameters_db.R | 0
.../parameters_optimization.R | 0
.../ODA/MetaboAnalyst_3.0.3/peak_utils.R | 0
.../MetaboAnalyst_3.0.3/peaks_to_function.R | 0
.../ODA/MetaboAnalyst_3.0.3/power_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/preproc_utils.R | 0
.../project_sharing_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/qs/all/hsa.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/all/mmu.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/blood.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/compound_db.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/csf.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/drug.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/fecal.qs | Bin
.../MetaboAnalyst_3.0.3/qs/kegg_pathway.qs | Bin
.../qs/lipid/lipid_compound_db.qs | Bin
.../qs/lipid/lipid_syn_nms.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/location.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/main_class.qs | Bin
.../qs/master_compound_db.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/metab/hsa.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/metab/mmu.qs | Bin
.../MetaboAnalyst_3.0.3/qs/metpa/kegg/hsa.qs | Bin
.../qs/metpa/kegg/human.qs | 0
.../MetaboAnalyst_3.0.3/qs/metpa/kegg/mmu.qs | Bin
.../MetaboAnalyst_3.0.3/qs/metpa/smpdb/hsa.qs | Bin
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.../ODA/MetaboAnalyst_3.0.3/qs/predicted.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/self-name.qs | 0
.../MetaboAnalyst_3.0.3/qs/smpdb_pathway.qs | Bin
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.../ODA/MetaboAnalyst_3.0.3/qs/sub_class.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/super_class.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/urine.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/share_projects.R | 0
.../MetaboAnalyst_3.0.3/spectra_processing.R | 0
.../ODA/MetaboAnalyst_3.0.3/spectra_utils.R | 0
.../sqlite/hsa_genes.sqlite | Bin
.../sqlite/mmu_genes.sqlite | Bin
.../MetaboAnalyst_3.0.3/stats_chemometrics.R | 0
.../stats_classification.R | 0
.../MetaboAnalyst_3.0.3/stats_clustering.R | 0
.../MetaboAnalyst_3.0.3/stats_correlations.R | 0
.../ODA/MetaboAnalyst_3.0.3/stats_opls.R | 0
.../ODA/MetaboAnalyst_3.0.3/stats_peaks.R | 0
.../ODA/MetaboAnalyst_3.0.3/stats_plot3d.R | 0
.../MetaboAnalyst_3.0.3/stats_sigfeatures.R | 0
.../ODA/MetaboAnalyst_3.0.3/stats_spls.R | 0
.../MetaboAnalyst_3.0.3/stats_univariates.R | 0
.../sweave_report_biomarker.R | 0
.../sweave_report_enrichment.R | 0
.../sweave_report_integmex.R | 0
.../sweave_report_meta_analysis.R | 0
.../sweave_report_mummichog.R | 0
.../sweave_report_network.R | 0
.../sweave_report_pathway.R | 0
.../MetaboAnalyst_3.0.3/sweave_report_power.R | 0
.../sweave_report_raw_spectra.R | 0
.../MetaboAnalyst_3.0.3/sweave_report_stats.R | 0
.../MetaboAnalyst_3.0.3/sweave_report_time.R | 0
.../ODA/MetaboAnalyst_3.0.3/sweave_reporter.R | 0
.../MetaboAnalyst_3.0.3/time_asca_heatmap2.R | 0
.../ODA/MetaboAnalyst_3.0.3/time_mb.R | 0
.../ODA/MetaboAnalyst_3.0.3/time_pca_anova2.R | 0
{V2.0d_test => V2.1}/ODA/ODA.R | 0
{V2.0c => V2.1}/ODA/constants.R | 0
{V2.0c => V2.1}/ODA/getData.R | 0
{V2.0c => V2.1}/ODA/getSettings.R | 0
{V2.0d_test => V2.1}/ODA/libraries.R | 0
{V2.0c => V2.1}/ODA/odaObject.R | 0
{V2.0c => V2.1}/ODA/statTests.R | 0
{V2.0c => V2.1}/ODA/transformData.R | 0
.../ODA/workBook.R | 0
.../data_template_V2.1.xlsx | Bin
V2.0d_test/run_analysis.sh => V2.1/oda.sh | 13 ++++-------
V2.1/run_analysis.sh | 9 +++++++
V2.1/test_data.xlsx | Bin 0 -> 146325 bytes
.../customized_DB_example_HMDB.csv | 0
.../customized_DB_example_KEGG.csv | 0
.../customized_DB_example_Name.csv | 0
.../reference_metabolites_example_HMDB.txt | 0
.../reference_metabolites_example_KEGG.txt | 0
.../reference_metabolites_example_Name.txt | 0
{V2.0c => archived/V2.0c}/ODA/MetaboAnalyst.R | 0
.../MetaboAnalyst_3.0.3/All_generic_utils.R | 0
.../MetaboAnalyst_3.0.3/batch_effect_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/biomarker_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/data_trimming.R | 0
.../dependencies_function_imported.R | 0
.../ODA/MetaboAnalyst_3.0.3/enrich_graphics.R | 0
.../ODA/MetaboAnalyst_3.0.3/enrich_integ.R | 0
.../ODA/MetaboAnalyst_3.0.3/enrich_mset.R | 0
.../MetaboAnalyst_3.0.3/enrich_name_match.R | 0
.../enrich_path_graphics.R | 0
.../MetaboAnalyst_3.0.3/enrich_path_stats.R | 0
.../ODA/MetaboAnalyst_3.0.3/enrich_stats.R | 0
.../ODA/MetaboAnalyst_3.0.3/gene_fun_utils.R | 0
.../MetaboAnalyst_3.0.3/general_anot_utils.R | 0
.../MetaboAnalyst_3.0.3/general_data_utils.R | 0
.../MetaboAnalyst_3.0.3/general_lib_utils.R | 0
.../MetaboAnalyst_3.0.3/general_load_libs.R | 0
.../MetaboAnalyst_3.0.3/general_misc_utils.R | 0
.../MetaboAnalyst_3.0.3/general_norm_utils.R | 0
.../MetaboAnalyst_3.0.3/general_proc_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/generic_c_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/meta_data_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/meta_methods.R | 0
.../ODA/MetaboAnalyst_3.0.3/meta_pathway.R | 0
.../misc_effect_size_functions.R | 0
.../ODA/MetaboAnalyst_3.0.3/networks_data.R | 0
.../ODA/MetaboAnalyst_3.0.3/networks_enrich.R | 0
.../ODA/MetaboAnalyst_3.0.3/networks_view.R | 0
.../ODA/MetaboAnalyst_3.0.3/others_lipomics.R | 0
.../ODA/MetaboAnalyst_3.0.3/parameters_db.R | 0
.../parameters_optimization.R | 0
.../ODA/MetaboAnalyst_3.0.3/peak_utils.R | 0
.../MetaboAnalyst_3.0.3/peaks_to_function.R | 0
.../ODA/MetaboAnalyst_3.0.3/power_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/preproc_utils.R | 0
.../project_sharing_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/qs/all/hsa.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/all/mmu.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/blood.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/compound_db.qs | Bin
.../V2.0c}/ODA/MetaboAnalyst_3.0.3/qs/csf.qs | Bin
.../V2.0c}/ODA/MetaboAnalyst_3.0.3/qs/drug.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/fecal.qs | Bin
.../MetaboAnalyst_3.0.3/qs/kegg_pathway.qs | Bin
.../qs/lipid/lipid_compound_db.qs | Bin
.../qs/lipid/lipid_syn_nms.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/location.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/main_class.qs | Bin
.../qs/master_compound_db.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/metab/hsa.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/metab/mmu.qs | Bin
.../MetaboAnalyst_3.0.3/qs/metpa/kegg/hsa.qs | Bin
.../qs/metpa/kegg/human.qs | 0
.../MetaboAnalyst_3.0.3/qs/metpa/kegg/mmu.qs | Bin
.../MetaboAnalyst_3.0.3/qs/metpa/smpdb/hsa.qs | Bin
.../MetaboAnalyst_3.0.3/qs/metpa/smpdb/mmu.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/predicted.qs | Bin
.../ODA/MetaboAnalyst_3.0.3/qs/self-name.qs | 0
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.../V2.0c}/ODA/MetaboAnalyst_3.0.3/qs/snp.qs | Bin
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.../ODA/MetaboAnalyst_3.0.3/share_projects.R | 0
.../MetaboAnalyst_3.0.3/spectra_processing.R | 0
.../ODA/MetaboAnalyst_3.0.3/spectra_utils.R | 0
.../sqlite/hsa_genes.sqlite | Bin
.../sqlite/mmu_genes.sqlite | Bin
.../MetaboAnalyst_3.0.3/stats_chemometrics.R | 0
.../stats_classification.R | 0
.../MetaboAnalyst_3.0.3/stats_clustering.R | 0
.../MetaboAnalyst_3.0.3/stats_correlations.R | 0
.../ODA/MetaboAnalyst_3.0.3/stats_opls.R | 0
.../ODA/MetaboAnalyst_3.0.3/stats_peaks.R | 0
.../ODA/MetaboAnalyst_3.0.3/stats_plot3d.R | 0
.../MetaboAnalyst_3.0.3/stats_sigfeatures.R | 0
.../ODA/MetaboAnalyst_3.0.3/stats_spls.R | 0
.../MetaboAnalyst_3.0.3/stats_univariates.R | 0
.../sweave_report_biomarker.R | 0
.../sweave_report_enrichment.R | 0
.../sweave_report_integmex.R | 0
.../sweave_report_meta_analysis.R | 0
.../sweave_report_mummichog.R | 0
.../sweave_report_network.R | 0
.../sweave_report_pathway.R | 0
.../MetaboAnalyst_3.0.3/sweave_report_power.R | 0
.../sweave_report_raw_spectra.R | 0
.../MetaboAnalyst_3.0.3/sweave_report_stats.R | 0
.../MetaboAnalyst_3.0.3/sweave_report_time.R | 0
.../ODA/MetaboAnalyst_3.0.3/sweave_reporter.R | 0
.../MetaboAnalyst_3.0.3/time_asca_heatmap2.R | 0
.../V2.0c}/ODA/MetaboAnalyst_3.0.3/time_mb.R | 0
.../ODA/MetaboAnalyst_3.0.3/time_pca_anova2.R | 0
{V2.0c => archived/V2.0c}/ODA/ODA.R | 0
.../V2.0c}/ODA/constants.R | 0
.../V2.0c}/ODA/getData.R | 0
.../V2.0c}/ODA/getSettings.R | 0
{V2.0c => archived/V2.0c}/ODA/libraries.R | 0
.../V2.0c}/ODA/odaObject.R | 0
.../V2.0c}/ODA/statTests.R | 0
.../V2.0c}/ODA/transformData.R | 0
{V2.0c => archived/V2.0c}/ODA/workBook.R | 0
.../V2.0c}/data_template_V2.0c.xlsx | Bin
{V2.0c => archived/V2.0c}/run_analysis.sh | 0
.../ODA/MetaboAnalyst.R | 0
.../MetaboAnalyst_3.0.3/All_generic_utils.R | 0
.../MetaboAnalyst_3.0.3/batch_effect_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/biomarker_utils.R | 0
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.../MetaboAnalyst_3.0.3/enrich_path_stats.R | 0
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.../MetaboAnalyst_3.0.3/general_anot_utils.R | 0
.../MetaboAnalyst_3.0.3/general_data_utils.R | 0
.../MetaboAnalyst_3.0.3/general_lib_utils.R | 0
.../MetaboAnalyst_3.0.3/general_load_libs.R | 0
.../MetaboAnalyst_3.0.3/general_misc_utils.R | 0
.../MetaboAnalyst_3.0.3/general_norm_utils.R | 0
.../MetaboAnalyst_3.0.3/general_proc_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/generic_c_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/meta_data_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/meta_methods.R | 0
.../ODA/MetaboAnalyst_3.0.3/meta_pathway.R | 0
.../misc_effect_size_functions.R | 0
.../ODA/MetaboAnalyst_3.0.3/networks_data.R | 0
.../ODA/MetaboAnalyst_3.0.3/networks_enrich.R | 0
.../ODA/MetaboAnalyst_3.0.3/networks_view.R | 0
.../ODA/MetaboAnalyst_3.0.3/others_lipomics.R | 0
.../ODA/MetaboAnalyst_3.0.3/parameters_db.R | 0
.../parameters_optimization.R | 0
.../ODA/MetaboAnalyst_3.0.3/peak_utils.R | 0
.../MetaboAnalyst_3.0.3/peaks_to_function.R | 0
.../ODA/MetaboAnalyst_3.0.3/power_utils.R | 0
.../ODA/MetaboAnalyst_3.0.3/preproc_utils.R | 0
.../project_sharing_utils.R | 0
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.../ODA/MetaboAnalyst_3.0.3/share_projects.R | 0
.../MetaboAnalyst_3.0.3/spectra_processing.R | 0
.../ODA/MetaboAnalyst_3.0.3/spectra_utils.R | 0
.../sqlite/hsa_genes.sqlite | Bin
.../sqlite/mmu_genes.sqlite | Bin
.../MetaboAnalyst_3.0.3/stats_chemometrics.R | 0
.../stats_classification.R | 0
.../MetaboAnalyst_3.0.3/stats_clustering.R | 0
.../MetaboAnalyst_3.0.3/stats_correlations.R | 0
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.../ODA/MetaboAnalyst_3.0.3/stats_peaks.R | 0
.../ODA/MetaboAnalyst_3.0.3/stats_plot3d.R | 0
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.../ODA/MetaboAnalyst_3.0.3/stats_spls.R | 0
.../MetaboAnalyst_3.0.3/stats_univariates.R | 0
.../sweave_report_biomarker.R | 0
.../sweave_report_enrichment.R | 0
.../sweave_report_integmex.R | 0
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.../sweave_report_mummichog.R | 0
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.../sweave_report_pathway.R | 0
.../MetaboAnalyst_3.0.3/sweave_report_power.R | 0
.../sweave_report_raw_spectra.R | 0
.../MetaboAnalyst_3.0.3/sweave_report_stats.R | 0
.../MetaboAnalyst_3.0.3/sweave_report_time.R | 0
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.../V2.0c_Standalone_07282023}/ODA/getData.R | 0
.../ODA/getSettings.R | 0
.../ODA/libraries.R | 0
.../ODA/odaObject.R | 0
.../ODA/statTests.R | 0
.../ODA/transformData.R | 0
.../V2.0c_Standalone_07282023}/ODA/workBook.R | 0
.../data_template_V2.0c.xlsx | Bin
.../run_analysis.sh | 0
331 files changed, 14 insertions(+), 30 deletions(-)
delete mode 100755 Change_Log.txt
rename {V2.0d_test => V2.1}/CRI_HMDB_KEGG_IDs.xlsx (100%)
rename {V2.0c => V2.1}/FileExamples/Customized_DB_for_Enrichment_or_Pathway_Analysis/customized_DB_example_HMDB.csv (100%)
rename {V2.0c => V2.1}/FileExamples/Customized_DB_for_Enrichment_or_Pathway_Analysis/customized_DB_example_KEGG.csv (100%)
rename {V2.0c => V2.1}/FileExamples/Customized_DB_for_Enrichment_or_Pathway_Analysis/customized_DB_example_Name.csv (100%)
rename {V2.0c => V2.1}/FileExamples/Reference_Metabolites_for_Enrichment_or_Pathway_Analysis/reference_metabolites_example_HMDB.txt (100%)
rename {V2.0c => V2.1}/FileExamples/Reference_Metabolites_for_Enrichment_or_Pathway_Analysis/reference_metabolites_example_KEGG.txt (100%)
rename {V2.0c => V2.1}/FileExamples/Reference_Metabolites_for_Enrichment_or_Pathway_Analysis/reference_metabolites_example_Name.txt (100%)
rename {V2.0d_test => V2.1}/ODA/MetaboAnalyst.R (100%)
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diff --git a/Change_Log.txt b/Change_Log.txt
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@@ -1,22 +0,0 @@
-#########################################################################
-Change Log:
-#v1.7.4, 03/17/2021: MetaboAnalyst's ORA and QEA analyses were added. ORA analysis is done when interested features are supplied. QEA analysis is done following differential feature tests. A bug causing missing control vs. treatment result sheets was fixed. Value filter was fixed at 0. Group mean lower bound and log offset default values were revised. Data imputation was done after normalization and before log2 transformation. If imputation method was mean, median, or half minimum, log offset was disabled. Scaling option for heatmap, PCA, and correlation plots was added.
-#v1.7.3, 08/04/2020: R 4.0.2 was tested. Data template was changed to .xlsx. Macro was no longer needed. Library path was changed to ~/R/4.0.2-gccmkl for BioHPC. PCA labels and ellipses were added. Heatmap colors were added.
-#v1.7.2, 03/26/2020: A bug regarding empty feature IDs was fixed.
-#v1.7.1, 12/04/2019: Figures were saved as both .ps and .png files. Euler plot was disabled for >6 samples. Samples / features can be clustered or not on the heatmaps.
-#v1.7.0, 10/22/2019: Figures were saved as .ps files in a Figure folder. Correlation plot was genrated with the old method for better speed. Euler plot was disabled for >10 samples. Y axis of volcano plot could be raw or adjusted p-values. DESeq was renamed RLE as I would implement the DESeq differential expression analysis in the future. RLE is the same method used by DESeq but I slightly modified it to allow for zeros, missing values and / or values below the value filter. Due to this reason I couldn't use the DESeq normalization directly.
-#v1.6.9, 10/4/2019: A bug regarding cpglm was fixed. The bug caused an error in cpglm fitting but the class(fit) was still 'cpglm' and fit$converged was still TRUE. Visualization option was added. Version number checkup was added for the data template. Multiple other minor improvements.
-#v1.6.8, 09/19/2019: A bug regarding featureDescription was fixed. The bug was present only when data format was "table with feature description" and samples were excluded which happened to cause some features #v1.6.7, 08/29/2019: Correlation plot was enchanced. Euler diagram was added. Software version number was reported in the result file.
-#v1.6.6, 08/28/2019: Data table with feature description column was enabled, minor bugs fixed, and volcano plot colors customized.
-#v1.6.5, 08/27/2019: A bug regarding number of features per sample when data imputation = "NA" was fixed.
-#v1.6.4, 08/08/2019: A bug regarding groupMeanLowerBound was fixed. Definition and default value of groupCountFilter were modified. Data imputation was implemented. Missing values were allowed.
-#v1.6.3, 08/05/2019: a bug regarding nSamples and formula string generation (only when technical replicates are present) was fixed.
-#v1.6.2, 07/24/2019: a bug regarding normalization size factors was fixed. The bug caused size factors to be applied to incorrect samples. If you have used versions before this fix, please rerun your analysis using this fixed version.
-#v1.6.1, 07/03/2019: a bug regarding numerical batch IDs was fixed.
-#v1.6, 06/24/2019: Multiple normalization methods; visualization plots; sample exclusion; feature exclusion; cpglm and glm for statistical tests;
-#v1.5, 03/13/2019: If logTransform enabled, data=log2(data+logOffset) before statistical tests; p-values are FDR-adjusted; Bugs fixed; normalization enabled;
-#v1.4, 01/18/2019: Added functionality. (1) Averaging technical replicates. (2) Auto-IDs.
-#v1.1-1.3: Bugs fixed.
-#v1.0: Basic analysis including counting features and t-tests.
-#########################################################################
-
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diff --git a/V2.0c/ODA/MetaboAnalyst_3.0.3/sweave_report_mummichog.R b/V2.1/ODA/MetaboAnalyst_3.0.3/sweave_report_mummichog.R
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diff --git a/V2.0c/ODA/MetaboAnalyst_3.0.3/sweave_report_network.R b/V2.1/ODA/MetaboAnalyst_3.0.3/sweave_report_network.R
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diff --git a/V2.0c/ODA/MetaboAnalyst_3.0.3/sweave_report_stats.R b/V2.1/ODA/MetaboAnalyst_3.0.3/sweave_report_stats.R
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diff --git a/V2.0c_Standalone_07282023/ODA/workBook.R b/V2.1/ODA/workBook.R
old mode 100755
new mode 100644
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diff --git a/V2.0c/data_template_V2.0c.xlsx b/V2.1/data_template_V2.1.xlsx
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diff --git a/V2.0d_test/run_analysis.sh b/V2.1/oda.sh
similarity index 70%
rename from V2.0d_test/run_analysis.sh
rename to V2.1/oda.sh
index 2f41953..9e75d5d 100755
--- a/V2.0d_test/run_analysis.sh
+++ b/V2.1/oda.sh
@@ -13,16 +13,13 @@ then
echo "########## ODA Tool Usage ##########"
exit
fi
-#module load R/4.0.2-gccmkl #Comment this line out (adding a # at the beginning) if running from your own computer.
-module load singularity/3.9.9
-ODA_MODULE=/archive/CRI/shared/Singularity/zzy/r_w_packages_4.3.2.sif
-DIR=`dirname $0`
+ODA_DIR=`dirname $0`
INPUT_FILE=$1
OUTPUT_FOLDER=$2
QUEUE=$3
if [ "$QUEUE" == "" ]
then
- QUEUE=256GB
+ QUEUE=local
fi
if [ -d "$OUTPUT_FOLDER" ]
@@ -40,7 +37,7 @@ fi
mkdir -p $OUTPUT_FOLDER
if [ "$QUEUE" == "local" ]
then
- singularity exec $ODA_MODULE Rscript $DIR/ODA/ODA.R $INPUT_FILE $OUTPUT_FOLDER 2>&1 | tee -a $OUTPUT_FOLDER/ODA_run.log
-#else
-# srun -p $QUEUE Rscript $DIR/ODA/ODA.R $INPUT_FILE $OUTPUT_FOLDER 2>&1 | tee -a $OUTPUT_FOLDER/ODA_run.log
+ sh $ODA_DIR/run_analysis.sh $ODA_DIR $INPUT_FILE $OUTPUT_FOLDER
+else
+ sbatch -p $QUEUE $ODA_DIR/run_analysis.sh $ODA_DIR $INPUT_FILE $OUTPUT_FOLDER
fi
diff --git a/V2.1/run_analysis.sh b/V2.1/run_analysis.sh
new file mode 100644
index 0000000..dae341f
--- /dev/null
+++ b/V2.1/run_analysis.sh
@@ -0,0 +1,9 @@
+#!/bin/bash
+#module load R/4.0.2-gccmkl #Comment this line out (adding a # at the beginning) if running from your own computer.
+module load singularity/3.9.9
+ODA_MODULE=/archive/CRI/shared/Singularity/zzy/r_w_packages_4.3.2.sif
+ODA_DIR=$1
+INPUT_FILE=$2
+OUTPUT_FOLDER=$3
+singularity exec $ODA_MODULE Rscript $ODA_DIR/ODA/ODA.R $INPUT_FILE $OUTPUT_FOLDER 2>&1 | tee -a $OUTPUT_FOLDER/ODA_run.log
+
diff --git a/V2.1/test_data.xlsx b/V2.1/test_data.xlsx
new file mode 100755
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