SimpleCompChem

Some scripts to simpify the life of the computational chemist

Name		Name	Last commit message	Last commit date
Latest commit History 7 Commits
.idea		.idea
ORCA_NBO_parsers		ORCA_NBO_parsers
.gitignore		.gitignore
Interactive_linear_regression.py		Interactive_linear_regression.py
LICENSE		LICENSE
README.md		README.md
Reaction_Paths.py		Reaction_Paths.py
Respect_ChemShift_parse.py		Respect_ChemShift_parse.py
correlation_matrix_plot.py		correlation_matrix_plot.py

Provide feedback