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gbyuvd/sabrlo-chem-selfies-training

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Hugging Face2025-09-26 更新2025-10-25 收录
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https://hf-mirror.com/datasets/gbyuvd/sabrlo-chem-selfies-training
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资源简介:
Valid Bioactives and Natural Product SELFIES数据集是从ChemBL34、COCONUTDB和Supernatural3三个数据库中构建的,包含约100万个有效的SELFIES,每个SELFIES的序列长度不超过25。该数据集经过筛选和清洗,用于ChemMiniQ3-SAbRLo模型的训练,并被分割成6个大致相等的部分以便于在有限计算资源下进行训练。

The Valid Bioactives and Natural Product SELFIES dataset consists of approximately 1 million valid SELFIES with a seq_len of 25 or less, built from ChemBL34, COCONUTDB, and Supernatural3. It has been filtered and cleaned for training the ChemMiniQ3-SAbRLo model and split into 6 approximately equal chunks for training under limited compute resources.
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