Contribution is always welcome. All contributions must go through pull requests and code review.
Below is a list of community contributors for this project.
- Chengqiang Lu: Alchemy dataset; MPNN, MGCN and SchNet
- Jiajing Hu: Weave
- Zhaoqiang Chen: Update RDkit channel for conda installation; Suggestions and improvement for rexgen_direct
- Yue Zhong: HadamardLinkPredictor, link prediction for ogbl-ppa
- Yangkang Zhang: GNNOGBPredictor, graph property prediction for ogbg-ppa, support for GuacaMol in JTVAE
- Sooheon Kim: Parallel processing for dataset construction from a CSV file
- Krishna Sirumalla: Fix for regression_inference.py and classification_inference.py; support non-ring systems for ScaffoldSplitter
- Joshua Meyers: Fix for load_molecule
- Pavol Drotar: Fix for import
- Nanxuan Zhou: Fix for doc
- mar-volk: Fix for rexgen_direct
- Wenxuan Fan: Strategies for Pre-training Graph Neural Networks
- Vignesh Venkataraman: PAGTN
- Eric O. Korman: Fix for ogbg_ppa
- Marcos Leal: Change default number of processes to 1 for rexgen