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smartniz / tljh-rxns

Plugin for TLJH for computational chemistry

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Rxns Stack Plugin for The Littlest Jupyter Hub

A plugin for The Littlest JupyterHub that installs packages useful for chemistry.

Installed software

  1. NUMFocus: Scipy, numpy, matplotlib and pandas
  2. Machine Learning: scikit-learn, pytorch, tensorflow
  3. Chemistry: rdkit
  4. Other: graph-tool

About

Plugin for TLJH for computational chemistry

Languages

Language:Python 100.0%