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Popular GitHub Repositories for Molecular Structures

Discover the most popular open-source projects and tools related to Molecular Structures, 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

Bayesian Illumination

bayesian-optimization

Bayesian Illumination is an accelerated generative model for optimization of small molecules.

1个月前