From ab0a68aee95d0e5bd9f7c223f3cbf2d7b6fabfac Mon Sep 17 00:00:00 2001 From: gbayarri Date: Wed, 22 Jan 2025 20:09:28 +0100 Subject: [PATCH] Tests Amber MD setup wf --- biobb_wf_amber_abc_setup/python/workflow.env.yml | 2 -- biobb_wf_amber_md_setup/python/workflow.env.yml | 3 ++- biobb_wf_amber_md_setup_lig/python/workflow.env.yml | 4 +--- 3 files changed, 3 insertions(+), 6 deletions(-) diff --git a/biobb_wf_amber_abc_setup/python/workflow.env.yml b/biobb_wf_amber_abc_setup/python/workflow.env.yml index 9b734ed..a95e928 100644 --- a/biobb_wf_amber_abc_setup/python/workflow.env.yml +++ b/biobb_wf_amber_abc_setup/python/workflow.env.yml @@ -5,5 +5,3 @@ channels: dependencies: - biobb_amber>=5.0.2 - biobb_analysis>=5.0.1 - - diff --git a/biobb_wf_amber_md_setup/python/workflow.env.yml b/biobb_wf_amber_md_setup/python/workflow.env.yml index b956ce2..b28cdfb 100644 --- a/biobb_wf_amber_md_setup/python/workflow.env.yml +++ b/biobb_wf_amber_md_setup/python/workflow.env.yml @@ -6,4 +6,5 @@ dependencies: - biobb_structure_utils>=5.0.0 - biobb_chemistry>=5.0.3 - biobb_amber>=5.0.2 - - biobb_analysis>=5.0.1 \ No newline at end of file + - biobb_analysis>=5.0.1 + diff --git a/biobb_wf_amber_md_setup_lig/python/workflow.env.yml b/biobb_wf_amber_md_setup_lig/python/workflow.env.yml index 602f09e..b956ce2 100644 --- a/biobb_wf_amber_md_setup_lig/python/workflow.env.yml +++ b/biobb_wf_amber_md_setup_lig/python/workflow.env.yml @@ -6,6 +6,4 @@ dependencies: - biobb_structure_utils>=5.0.0 - biobb_chemistry>=5.0.3 - biobb_amber>=5.0.2 - - biobb_analysis>=5.0.1 - - + - biobb_analysis>=5.0.1 \ No newline at end of file