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  1. quantum-gflownets quantum-gflownets Public

    Jupyter Notebook

  2. SMU-CATCO/SmartCADD SMU-CATCO/SmartCADD Public

    SmartCADD is an open-source virtual screening platform that combines deep learning, computer-aided drug design (CADD), and quantum mechanics methodologies within a user-friendly Python framework.

    Python 10

  3. pytorch_geometric pytorch_geometric Public

    Forked from pyg-team/pytorch_geometric

    Graph Neural Network Library for PyTorch

    Python

  4. xinsight-graph-explanations xinsight-graph-explanations Public

    Implementation of the XInsight Model-Level Explanation Algorithm proposed in https://arxiv.org/abs/2306.04791

    Python

  5. awesome-development-notes awesome-development-notes Public

    Collection of helpful Stack-overflow, Medium, etc. posts for software development.

  6. CS7350-Algorithm-Engineering CS7350-Algorithm-Engineering Public

    This repo is used for CS7350 Algorithm Engineering homework programs and the final project

    C