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  • Due by July 14, 2023
    3/3 issues closed
  • Due by July 14, 2023
    5/5 issues closed
  • No due date
    5/5 issues closed
  • Publicly releasing the library

    Due by July 3, 2023
    4/4 issues closed
  • Due by March 11, 2023
    16/16 issues closed
  • Make the documentation ready for publishing, and improving the current code for better readability and usability.

    Due by February 28, 2023
    18/18 issues closed
  • Due by December 23, 2022
    11/11 issues closed
  • Issues that are important don't need to be resolved to reproduce GPS++

    Due by January 20, 2023
    3/3 issues closed
  • Using the new compiler, which should enable float16 support. Implementing Mup to enable better parameter transfer Using better node-edge features, such as angles and torsion will be beneficial (especially angles). Implementing node-level tasks and edge-level tasks will also allow the network to better understand the different aspects of the molecule. Re-designing the architectures to simplify how nodes and edges are passed to the model. Cache the processed data to allow for more compute-heavy features.

    Due by November 22, 2022
    10/10 issues closed
  • We need Goli to be able to replicate the internal model, do a hyper-parameter search, and compete on the OGB-PCQM4Mv2 leaderboard. Also, we need it as fast as possible to reduce the computing burden. The required steps are: - Fixing the `GraphOGBDataModule` - Accumulating gradient - Using mixed precision (moved to next milestone since using new compiler) - Support metrics with NaNs on the targets - Fix the logging of the training metrics - Implement MuTransfer and MuAdam (moved to new milestone since more complex) - Fix the learning-rate scheduling options

    Due by October 5, 2022
    9/9 issues closed