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Tutorials

Hands-on, runnable notebooks that build on the Quickstart. Each renders inline here and can be opened directly in Google Colab.

  •   Splitter Quickstart


    From raw SMILES to a validated OOD split in a few cells. The best place to start — Colab-ready, lean install only.

    Open tutorial

  •   Example Workflow


    A fuller walkthrough of the splitting and analysis API on a real dataset.

    Open tutorial

  •   Visualization


    Reproduce the ID/OOD comparison figures — heatmaps, distance distributions, and the accuracy-on-the-line plots.

    Open tutorial

Run in Colab

The Splitter Quickstart is available directly on Google Colab — no local install required.