.. _chemistream_tutorials: Tutorials/Demos ************************************* .. Paste the name of movie from 1st Camtasia link and put into 'embed' location below. Setup Remote HPC cluster with Chemistream app ================================================ .. raw:: html
*Full 1080p HD resolution and full-screen available through menu on the bottom right of the video* Turnkey Simulation Workflows ================================== NWChem Scaling Study ------------------------ .. raw:: html
*Full 1080p HD resolution and full-screen available through menu on the bottom right of the video* Running Dalton using SMILES Input ----------------------------------- .. raw:: html
*Full 1080p HD resolution and full-screen available through menu on the bottom right of the video* Advanced Simulation Workflows ================================== These tutorials give details about how to use Chemistream to enable specific simulation workflows in the cloud. These workflows assume an advanced knowledge of how to use the underlying Chemistream functionality. NOTE: while there are features of each of these tutorials that are similar to one another, each one has differences in how the workflows are implemented in order to give a sense of the flexibility in how users can interact with HPC cloud resources using Chemistream. .. toctree:: :maxdepth: 1 remote_spparks_ising_workflow.rst remote_lmp_peptide_workflow.rst run_vorpal_in_cloud.rst remote_nwchem_workflow.rst remote_p3ht_workflow.rst ml_alfabet.rst remote_storage_opv.rst bde_training_data.rst Compute Session Jupyterlab Tips ================================================ .. image:: ../images/remote_intro_1.png :width: 95% .. image:: ../images/remote_intro_5.png :width: 95% Coming Soon ============================ .. toctree:: :maxdepth: 1 troubleshooting_1.rst remote_ald_workflow.rst charge_analysis_ddec6.rst rl_workflow.rst