liuganghuggingface/moldata-simpoly_experiment

SimPoly PolyArena experimental benchmark Microsoft Research reference room-temperature density and glass-transition benchmark for 130 polymers, collected from Bicerano. Processed copy of simpoly_experiment from the molecular datasets collection. Structures are canonicalized and validated; labels are never averaged or filled. Prefer the original source for citation. Where the data comes from Original data: https://github.com/microsoft/simpoly Original study:… See the full description on the dataset page: https://huggingface.co/datasets/liuganghuggingface/moldata-simpoly_experiment.

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