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  1. CHARMM-Parameter-File-Search-Engine CHARMM-Parameter-File-Search-Engine Public

    CHARMM Parameter File Search Engine: A web-based application designed for parsing, viewing, and analyzing CHARMM parameter files. This tool offers an intuitive interface for researchers and develop…

    JavaScript

  2. mdf-parser-cli mdf-parser-cli Public

    The MDF Parser CLI Tool is a command-line application designed to parse .mdf (Molecular Data Format) files and extract molecular topology information. It efficiently processes molecular structures,…

    Python

  3. molecular-topology-toolkit molecular-topology-toolkit Public

    A Python toolkit for computational chemistry and materials science, providing tools for molecular topology analysis, force field parameter handling, and more.

    Python