Combining data-driven & first-principles approaches to build a model, we proposed GEM-2, a novel method that comprehensively considers full-range many-body interactions in molecules.
Paper: https://
arxiv.org/abs/2208.05863
GitHub at #PaddlePaddle: https://
github.com/PaddlePaddle/P
addleHelix/tree/dev/apps/pretrained_compound/ChemRL/GEM-2
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