The Schultz Lab

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1. QuantUI QuantUIPublic

   QuantUI puts PySCF behind an interactive Jupyter/Voilà UI. Run DFT, MP2, TD-DFT, NMR, geometry optimization, frequencies, and PES scans — visualize structures, orbitals, IR and UV-Vis spectra, all …

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2. plotlyMol plotlyMolPublic

   Forked from ProfLear/plotlyMol

   Interactive 3D molecular visualization in Python — ball-and-stick, VDW, orbital rendering, and a Dash GUI. Built on Plotly and RDKit.

   Python 1 1

3. plottle plottlePublic

   A general-purpose Python toolkit for scientific data visualization and analysis, developed for research and teaching in computational science at North Carolina Central University.

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