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  1. Implementation of Edge Attention based Multi-relational Graph Convolutional Networks

    Python 96 26

  2. Scalable, Portable and Distributed Gradient Boosting (GBDT, GBRT or GBM) Library, for Python, R, Java, Scala, C++ and more. Runs on single machine, Hadoop, Spark, Flink and DataFlow

    C++ 15.7k 6.6k

  3. Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

    Python 1.5k 497

8 contributions in 2019

Jan Feb Mar Apr May Jun Jul Aug Sep Oct Nov Dec Mon Wed Fri

Contribution activity

April 2019

Created a pull request in cdk/cdk that received 4 comments

Fix bug in NeighborList and related test

Previously not all atoms are put into neighbor list, this will cause some points that are actually covered by atoms not get deleted, which cause th…

+6 −6 4 comments

Created an issue in cdk/cdk that received 5 comments

Incorrect Numerical Surface when read sdf file

Hi, I follow the steps you mentioned in #548 to read the sdf file. However, I found that I can not get the right numerical surface. (0 radius was u…


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