From b17a4cd9899e412cbdedc8587bc0dd3c013b624c Mon Sep 17 00:00:00 2001 From: hechth Date: Fri, 19 Jun 2026 11:55:24 +0200 Subject: [PATCH] updated rcx tools, including aoptk --- galaxy-umsa.grid.cesnet.cz/recetox.yml.lock | 4 ++++ usegalaxy.cz/machine_learning.yml.lock | 6 ++++++ usegalaxy.cz/metabolomics.yml.lock | 4 ++++ 3 files changed, 14 insertions(+) diff --git a/galaxy-umsa.grid.cesnet.cz/recetox.yml.lock b/galaxy-umsa.grid.cesnet.cz/recetox.yml.lock index 515f014..249b368 100644 --- a/galaxy-umsa.grid.cesnet.cz/recetox.yml.lock +++ b/galaxy-umsa.grid.cesnet.cz/recetox.yml.lock @@ -32,6 +32,7 @@ tools: - name: xtb_molecular_optimization owner: recetox revisions: + - 14a4d81e921e - 6e1ef071fffc - cba7123c2741 - d5633eaf3552 @@ -148,6 +149,7 @@ tools: - 54401f9d1a30 - 648f82934b56 - 9b4b624c4d60 + - fd2837c28c34 tool_panel_section_id: recetox tool_panel_section_label: RECETOX - name: ms2deepscore_config_generator @@ -235,12 +237,14 @@ tools: owner: recetox revisions: - 5668e27d0684 + - ce0420edec0f tool_panel_section_id: recetox tool_panel_section_label: RECETOX - name: aoptk_publication_tracker owner: recetox revisions: - 0f01dc62c4f3 + - 98893ab7309f tool_panel_section_id: recetox tool_panel_section_label: RECETOX - name: stratified_block_randomization diff --git a/usegalaxy.cz/machine_learning.yml.lock b/usegalaxy.cz/machine_learning.yml.lock index 3070c21..8b4a3c9 100644 --- a/usegalaxy.cz/machine_learning.yml.lock +++ b/usegalaxy.cz/machine_learning.yml.lock @@ -562,12 +562,14 @@ tools: - name: aoptk_parse_pdf owner: recetox revisions: + - 0471403ef9ce - a3655f6fe6e0 tool_panel_section_id: machine_learning tool_panel_section_label: Machine Learning - name: aoptk_normalize_chemicals owner: recetox revisions: + - 24b8c589e2eb - f5ffeece6ff5 tool_panel_section_id: machine_learning tool_panel_section_label: Machine Learning @@ -575,23 +577,27 @@ tools: owner: recetox revisions: - 887378d493be + - ecba3e952d53 tool_panel_section_id: machine_learning tool_panel_section_label: Machine Learning - name: aoptk_download_publication_data owner: recetox revisions: + - 792d078e6761 - bed4cc854248 tool_panel_section_id: machine_learning tool_panel_section_label: Machine Learning - name: aoptk_final_modification owner: recetox revisions: + - 53060147b091 - d121a63d5778 tool_panel_section_id: machine_learning tool_panel_section_label: Machine Learning - name: aoptk_find_relationships_chemicals owner: recetox revisions: + - 7f92e08ad375 - c0814e7a5d8e tool_panel_section_id: machine_learning tool_panel_section_label: Machine Learning diff --git a/usegalaxy.cz/metabolomics.yml.lock b/usegalaxy.cz/metabolomics.yml.lock index a32e6b3..f3b4342 100644 --- a/usegalaxy.cz/metabolomics.yml.lock +++ b/usegalaxy.cz/metabolomics.yml.lock @@ -630,6 +630,7 @@ tools: - 13de8005adba - 3f7790b73906 - 83c4b4359ac4 + - a26afcf352fd - a6583110825c tool_panel_section_id: metabolomics tool_panel_section_label: Metabolomics @@ -637,6 +638,7 @@ tools: owner: recetox revisions: - 1ffbd537984f + - a465cb84a388 - df85b26201d1 - fd890f162ce6 - fe9f3cd0b8dd @@ -653,6 +655,7 @@ tools: owner: recetox revisions: - 51205379251d + - 67b885502624 - 7504a8f93699 - 86727e1d0866 - 8832425b1ff6 @@ -673,6 +676,7 @@ tools: revisions: - 131baa30af82 - 9982b85ff4e7 + - ad859b8036ad - c42b977ec884 - f04b378325e5 tool_panel_section_id: metabolomics