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1. fanpy fanpy Public

   Framework for rapid prototyping of new wavefunction ansatz and other ab initio methods for the time-independent Schrodinger equation

   Python 4

2. theochem/gbasis theochem/gbasis Public

   Python library for analytical evaluation and integration of Gaussian-type basis functions and related quantities.

   Jupyter Notebook 91 45

3. docinstance docinstance Public

   Docstring wrapper to inherit components from the docstrings of parent class

   Python

4. theochem/chemtools theochem/chemtools Public

   A collection of interpretive chemical tools for analyzing outputs of the quantum chemistry calculations.

   Python 59 24