Unraveling the Mysteries of Matter: A Journey Through Computational Chemistry & Theoretical Insights

Category: Scripts

  • Zip It Your Way: A Bash Script for Selective File Archiving

    In computational chemistry research, organizing large datasets is essential. To streamline archiving selected files while preserving folder structures, I wrote a Bash script that compresses files based on extensions, facilitating archival of simulation results, inputs, and other critical data while excluding unnecessary files. The complete code of the script is given below: Download Link How…