-
- Downloads
refarctor
Showing
- .gitignore 3 additions, 0 deletions.gitignore
- README.md 2 additions, 2 deletionsREADME.md
- tutorial/Tutorial - Molecular Dynamics Trajectories and Workflows in NOMAD.ipynb 45 additions, 0 deletions...ecular Dynamics Trajectories and Workflows in NOMAD.ipynb
- tutorial/Tutorial 1 - Uploading MD Data/Images/NOMAD_Metainfo.png 0 additions, 0 deletions.../Tutorial 1 - Uploading MD Data/Images/NOMAD_Metainfo.png
- tutorial/Tutorial 1 - Uploading MD Data/Images/NOMAD_beta_button.png 0 additions, 0 deletions...torial 1 - Uploading MD Data/Images/NOMAD_beta_button.png
- tutorial/Tutorial 1 - Uploading MD Data/Images/NOMAD_uploads_button.png 0 additions, 0 deletions...ial 1 - Uploading MD Data/Images/NOMAD_uploads_button.png
- tutorial/Tutorial 1 - Uploading MD Data/Images/Processed_data.png 0 additions, 0 deletions.../Tutorial 1 - Uploading MD Data/Images/Processed_data.png
- tutorial/Tutorial 1 - Uploading MD Data/Images/Processed_data_edited.png 0 additions, 0 deletions...al 1 - Uploading MD Data/Images/Processed_data_edited.png
- tutorial/Tutorial 1 - Uploading MD Data/Images/Run_Calculation_0.png 0 additions, 0 deletions...torial 1 - Uploading MD Data/Images/Run_Calculation_0.png
- tutorial/Tutorial 1 - Uploading MD Data/Images/Run_Method.png 0 additions, 0 deletions...rial/Tutorial 1 - Uploading MD Data/Images/Run_Method.png
- tutorial/Tutorial 1 - Uploading MD Data/Images/Run_Program.png 0 additions, 0 deletions...ial/Tutorial 1 - Uploading MD Data/Images/Run_Program.png
- tutorial/Tutorial 1 - Uploading MD Data/Images/Run_System_0.png 0 additions, 0 deletions...al/Tutorial 1 - Uploading MD Data/Images/Run_System_0.png
- tutorial/Tutorial 1 - Uploading MD Data/Images/Run_System_0_Atoms.png 0 additions, 0 deletions...orial 1 - Uploading MD Data/Images/Run_System_0_Atoms.png
- tutorial/Tutorial 1 - Uploading MD Data/Images/Run_System_0_AtomsGroup.png 0 additions, 0 deletions... 1 - Uploading MD Data/Images/Run_System_0_AtomsGroup.png
- tutorial/Tutorial 1 - Uploading MD Data/Tutorial 1 - Uploading MD Data.ipynb 156 additions, 0 deletions... - Uploading MD Data/Tutorial 1 - Uploading MD Data.ipynb
- tutorial/Tutorial 1 - Uploading MD Data/water_workflow.zip 0 additions, 0 deletionstutorial/Tutorial 1 - Uploading MD Data/water_workflow.zip
- tutorial/Tutorial 2 - MD Overview Page and Workflow Visualizer/Images/workflow_graph.png 0 additions, 0 deletions...ew Page and Workflow Visualizer/Images/workflow_graph.png
- tutorial/Tutorial 2 - MD Overview Page and Workflow Visualizer/Tutorial 2 - Overview Page and Worfklow Visualizer.ipynb 110 additions, 0 deletions.../Tutorial 2 - Overview Page and Worfklow Visualizer.ipynb
- tutorial/Tutorial 2 - MD Overview Page and Workflow Visualizer/binary_mixture_pre-parsed.zip 0 additions, 0 deletions...age and Workflow Visualizer/binary_mixture_pre-parsed.zip
- tutorial/Tutorial 3 - Extracting Data and Trajectory Analysis/Appendix - MDAnalysis implementation commented.ipynb 354 additions, 0 deletions...ysis/Appendix - MDAnalysis implementation commented.ipynb
Loading
Please register or sign in to comment