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Bug fixes
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gbayarri committed Feb 28, 2024
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7 changes: 6 additions & 1 deletion .gitignore
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Expand Up @@ -54,4 +54,9 @@ biobb_wf_amber_md_setup/notebooks/*/*.rst
!biobb_wf_amber_md_setup/docs/source/_static/abcsetup/sander.md.nc
!biobb_wf_amber_md_setup/docs/source/_static/abcsetup/structure.ions.parmtop
!biobb_wf_amber_md_setup/docs/source/_static/abcsetup/structure.leap.4fs.top
!biobb_wf_amber_md_setup/docs/source/_static/abcsetup/sander.md.ncrst
!biobb_wf_amber_md_setup/docs/source/_static/abcsetup/sander.md.ncrst
biobb_wf_amber_md_setup/docs/notebooks/
biobb_wf_amber_md_setup/html/abcsetup/biobb_amber_ABC_setup.web.ipynb
biobb_wf_amber_md_setup/html/mdsetup/biobb_amber_setup_notebook.web.ipynb
biobb_wf_amber_md_setup/html/mdsetup_lig/biobb_amber_complex_setup_notebook.web.ipynb
biobb_wf_amber_md_setup/html/mdsetup_ph/biobb_amber_CpHMD_notebook.web.ipynb
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