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Achievement: YOLOAchievement: QuickdrawAchievement: StarstruckAchievement: Pair ExtraordinaireAchievement: Pull Sharkx2Achievement: Arctic Code Vault Contributor

Achievements

Achievement: YOLOAchievement: QuickdrawAchievement: StarstruckAchievement: Pair ExtraordinaireAchievement: Pull Sharkx2Achievement: Arctic Code Vault Contributor

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  1. aspuru-guzik-group/selfies aspuru-guzik-group/selfies Public

    Robust representation of semantically constrained graphs, in particular for molecules in chemistry

    Python 680 129

  2. torch-influence torch-influence Public

    A simple PyTorch implementation of influence functions.

    Python 79 10

  3. aspuru-guzik-group/kreed aspuru-guzik-group/kreed Public

    Code for Reflection-Equivariant Diffusion for 3D Structure Determination from Isotopologue Rotational Spectra in Natural Abundance

    Jupyter Notebook 5