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    2021.05.25

    The 1st Drug Development AI Competition

    Algorithm | SMILES | Tabular | Regression | Biology | RMSE

    Practice
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    Setup D-0

     

    DeepChem을 이용한 MPNN 학습

    파이썬초보만
    2023.09.04 08:52 5,615 Views language
    comments 2

    DeepChem 라이브러리를 이용한 MPNN(message passing neural network) 베이스라인입니다.
    리더보드 점수는 30점대입니다.

    DeepChem 공식 홈페이지에서 분자구조 데이터의 이해와 접근방법을 상세히 설명하니 참고하셔도 좋을 것 같습니다.
    https://deepchem.io/about

    Code
    2 Comments
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    주머니쥐
    2023.09.06 11:16

    코드 진짜 잘짜시네요!

    파이썬초보만
    2023.09.08 22:29

    감사합니다!

    📣 The comment input field has been moved to the top of the comment list!
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