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My Python Code for Various Molecular Structure Visualization and Analysis Tasks
- SPARTAN_FIXER - a program that fixes Spartan'08 output files in so-called PDB format, converting them to be true PDB format. The fixed files can then easily be used in Jmol.
- Python Scripts for Molecular Structure Analysis
- Much of the more involved code featured here is running in a webserver form here. You can enter your data and have it analyzed without needing to download anything.
See here for getting my code in a form you can use on your machine or that you can modify.