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Pinned

  1. paper-qa paper-qa Public

    LLM Chain for answering questions from documents with citations

    Python 3.7k 343

  2. dmol-book dmol-book Public

    Deep learning for molecules and materials book

    Jupyter Notebook 581 114

  3. symd symd Public

    N-Dimensional MD engine with symmetry group constraints

    Jupyter Notebook 43 6

  4. molbloom molbloom Public

    Molecular bloom filter tool

    Python 106 9

  5. synspace synspace Public

    Synthesis generative model

    Python 35 3

  6. protein-emoji protein-emoji Public

    Files and utilities for protein-emoji

    11