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Achievement: Pull Sharkx4Achievement: YOLOAchievement: Pair Extraordinairex4Achievement: Quickdraw

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  1. Chemvas Chemvas Public

    A lightweight PyQt6 app for drawing 2D chemical structures and reaction schemes.

    Python

  2. nmr_bind_fit nmr_bind_fit Public

    A command-line workflow for NMR titration binding analysis

    Python

  3. orca_auto orca_auto Public

    A queue-first runner for standalone ORCA and CREST→xTB→ORCA workflows

    Python 1