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Sam Smith
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Plotting Molecular Orbital Energy Diagrams
MOplots_MOproblems is a simple python script to plot and annotate molecular orbital energy diagrams from a csv file.
June 29, 2023
Fourier Image Processing
A simple GUI-based app for applying masks to image data in the Fourier space.
May 2, 2023
Speeding up Ligand Tuning
Computationally Guided HTE Synthesis of Fe(II) Polypyridine Molecules with MLCT Electronic Structure.
October 13, 2021
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