reaction-path

There are 0 repository under reaction-path topic.

• theochem / gopt

  Python library for optimizing molecular structures and determining chemical reaction pathways.

  chemical-reactionsgeometry-optimizationquantum-chemistryreaction-path
  Language:Python 17

• MFTabriz / reaction_pypaths

  A simple python script for drawing reaction path energy diagrams

  energy-diagramreaction-path
  Language:Python 3