@@ -170,7 +188,6 @@ diff -r 4e6281945270 -r 10093dea9b3f main.R --- a/main.R Thu May 26 16:46:13 2022 +0000 +++ b/main.R Fri Jun 10 10:14:43 2022 +0000 @@ -79,11 +79,8 @@ res <- unsupervised(filenames = sample_files, ...) - save_all_extracted_features(res$extracted_features, sample_files) - save_all_corrected_features(res$corrected_features, sample_files) - - save_aligned_feature_table(res$aligned_feature_sample_table, aligned_file) - save_recovered_feature_table(res$recovered_feature_sample_table, recovered_file, out_format) + save_all_features(res, sample_files) + save_all_feature_tables(res$aligned_feature_sample_table, res$recovered_feature_sample_table, aligned_file, recovered_file, out_format) } hybrid_main <- function(sample_files, known_table_file, updated_known_table_file, pairing_file, aligned_file, recovered_file, out_format, ...) { @@ -95,11 +92,22 @@ save_known_table(res$updated_known_table, updated_known_table_file) save_pairing(res$features_known_table_pairing, pairing_file) - save_all_extracted_features(res$extracted_features, sample_files) - save_all_corrected_features(res$corrected_features, sample_files) + save_all_features(res, sample_files) + save_all_feature_tables(res$aligned_feature_sample_table, res$recovered_feature_sample_table, aligned_file, recovered_file, out_format) +} - save_aligned_feature_table(res$aligned_feature_sample_table, aligned_file) - save_recovered_feature_table(res$recovered_feature_sample_table, recovered_file, out_format) +save_all_features <- function(result, sample_files) { + save_all_extracted_features(result$extracted_features, sample_files) + save_all_corrected_features(result$corrected_features, sample_files) +} + +save_all_feature_tables <- function(aligned_feature_sample_table, + recovered_feature_sample_table, + aligned_file, + recovered_file, + out_format) { + save_aligned_feature_table(aligned_feature_sample_table, aligned_file) + save_recovered_feature_table(recovered_feature_sample_table, recovered_file, out_format) } two_step_hybrid_main <- function(sample_files, known_table_file, updated_known_table_file, recovered_file, aligned_file, out_format, metadata, ...) { diff -r 4e6281945270 -r 10093dea9b3f recetox_aplcms_unsupervised.xml --- a/recetox_aplcms_unsupervised.xml Thu May 26 16:46:13 2022 +0000 +++ b/recetox_aplcms_unsupervised.xml Fri Jun 10 10:14:43 2022 +0000 @@ -78,7 +78,7 @@ - @@ -86,7 +86,7 @@

- + diff -r 4e6281945270 -r 10093dea9b3f test-data/corrected_expected/corrected_0.parquet Binary file test-data/corrected_expected/corrected_0.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/corrected_expected/corrected_1.parquet Binary file test-data/corrected_expected/corrected_1.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/corrected_expected/corrected_2.parquet Binary file test-data/corrected_expected/corrected_2.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/extracted_expected/extracted_0.parquet Binary file test-data/extracted_expected/extracted_0.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/extracted_expected/extracted_1.parquet Binary file test-data/extracted_expected/extracted_1.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/extracted_expected/extracted_2.parquet Binary file test-data/extracted_expected/extracted_2.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/int_cross_table.parquet Binary file test-data/int_cross_table.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/rt_cross_table.parquet Binary file test-data/rt_cross_table.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/tolerances.parquet Binary file test-data/tolerances.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised.recetox.parquet Binary file test-data/unsupervised.recetox.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised_output/corrected_features_0.parquet Binary file test-data/unsupervised_output/corrected_features_0.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised_output/corrected_features_1.parquet Binary file test-data/unsupervised_output/corrected_features_1.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised_output/corrected_features_2.parquet Binary file test-data/unsupervised_output/corrected_features_2.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised_output/extracted_features_0.parquet Binary file test-data/unsupervised_output/extracted_features_0.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised_output/extracted_features_1.parquet Binary file test-data/unsupervised_output/extracted_features_1.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised_output/extracted_features_2.parquet Binary file test-data/unsupervised_output/extracted_features_2.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised_output/unsupervised.recetox.parquet Binary file test-data/unsupervised_output/unsupervised.recetox.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised_output/unsupervised_aligned_feature_sample_table.parquet Binary file test-data/unsupervised_output/unsupervised_aligned_feature_sample_table.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised_output/unsupervised_recovered_feature_sample_table.parquet Binary file test-data/unsupervised_output/unsupervised_recovered_feature_sample_table.parquet has changed diff -r 4e6281945270 -r 10093dea9b3f test-data/unsupervised_recovered_feature_sample_table.parquet Binary file test-data/unsupervised_recovered_feature_sample_table.parquet has changed