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Popular GitHub Repositories for Molecular Property Prediction

Discover the most popular open-source projects and tools related to Molecular Property Prediction, and stay updated with the latest development trends and innovations.

Pre Training Via Denoising

deep-learning

Official implementation of pre-training via denoising for TorchMD-NET

1个月前

Samsung AI Challenge For Scientific Discovery

competition

?Samsung AI Challenge 2021 1? ???????

2周前

GREA

graph-neural-networks

[KDD'22] Source codes of "Graph Rationalization with Environment-based Augmentations"

1周前

ABT MPNN

attention-mechanism

An atom-bond transformer-based message passing neural network for molecular property prediction.

2周前

Geo DEG

efficient-deep-learning

[ICML 2023] Hierarchical Grammar-Induced Geometry for Data-Efficient Molecular Property Prediction

4周前