Triton Software Suites

Modules and Languages

• Modules
• Anaconda
  • Introduction
  • Conda General Commands
  • Conda Environment
  • Installing Your Own Anaconda
• R via Anaconda
  • Load Miniforge software module
  • Create the R conda environment
  • Common R package dependencies
  • Activating conda environment upon login
  • Running jobs

Data Science Tools

• Jupyterhub
  • Triton Jupyterhub Introduction
  • Using JupyterHub on Triton
  • Using Triton Jupyter Notebook
  • Switching to JupyterLab on Triton

Molecular Science Software

• Gaussian
• Gromacs
  • How to load Gromacs
• LAMMPS
  • How to load LAMMPS