the open
    research
    Contribute
    Back to the reading lists

    AI for science· 2018

    Automatic Chemical Design Using a Data-Driven Continuous Representation of Molecules

    Rafael Gómez-Bombarelli (first author) · 2018

    Read the original

    DOI 10.1021/acscentsci.7b00572OpenAlex W2529996553

    On the reading lists

    Why it matters

    Pioneered continuous molecular latent spaces for gradient-based optimization and chemical generation.

    Condensed from the expert lists' notes.

    The record

    First released
    2018 (from OpenAlex)
    Citations
    3,105 citations, as counted by OpenAlex (CC0)
    Named by
    the chatgpt list only
    Score
    0.332 · computed rank 524 · consensus 0.23, must-read 0, citations percentile 0.75 (2010s · science), awards 0, existing lists 0. Method

    Data sources

    Catalogue data from OpenAlex (CC0), Crossref (CC0 metadata; no abstracts are shown), arXiv, and Papers With Code (CC BY-SA 4.0). Each count names its source. See the method.