GitHub - keiran-rowell/Honours-thesis-code: The Python scripts I wrote during my Honours thesis work

keiran-rowell / Honours-thesis-code Public

The Python scripts I wrote during my Honours thesis work

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Name		Name	Last commit message	Last commit date
Latest commit History 12 Commits
FMO_facio_input_conversion.sh		FMO_facio_input_conversion.sh
PIEDA_mat.py		PIEDA_mat.py
PIEDA_mat.py Usage Examples		PIEDA_mat.py Usage Examples
PIEDA_plot.py		PIEDA_plot.py
ROWELL_3374843_Chemistry_Ball_Thesis.pdf		ROWELL_3374843_Chemistry_Ball_Thesis.pdf
generate_clusters_3A.sh		generate_clusters_3A.sh
minimise_bestmember.sh		minimise_bestmember.sh
nucleotide_interaction_energies.JPG		nucleotide_interaction_energies.JPG
terpy-Pt_thiol.frcmod		terpy-Pt_thiol.frcmod
terpy-Pt_thiol.mol2		terpy-Pt_thiol.mol2