hypnopump/unimol_pretrain
收藏Hugging Face2025-02-21 更新2025-04-12 收录
下载链接：
https://hf-mirror.com/datasets/hypnopump/unimol_pretrain
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资源简介：
这是一个包含化学分子信息的数据集，具体字段包括会议ID、坐标、SMILES表示、键信息和原始信息等。数据集分为训练集和验证集，共有2000万条训练样本和近100万条验证样本。数据集的总大小为约12.96GB，下载大小约为6.55GB。
This dataset contains chemical molecule information, with fields including conference ID, coordinates, SMILES representation, key information, and origin information, etc. The dataset is split into a training set and a validation set, with a total of 20 million training samples and nearly 1 million validation samples. The total size of the dataset is approximately 12.96GB, with a download size of about 6.55GB.
提供机构：
hypnopump
