PARP1 Inhibitors Discovery:Innovative Screening Strategies Incorporating Machine Learning and Fragment Replacement Techniques

The dataset contains the data from a paper entitled "PARP1 Inhibitors Discovery:Innovative Screening Strategies Incorporating Machine Learning and Fragment Replacement Techniques". Both the training and test sets used for machine learning model training and validation in the article are included. In addition, data for Z-score line chart generation is included in the dataset.

本数据集包含一篇题为《PARP1抑制剂研发：融合机器学习与片段替换技术的创新性筛选策略》的论文相关数据。文中用于机器学习模型训练与验证的训练集与测试集均已收录其中。此外，数据集还包含用于生成Z分数（Z-score）折线图的相关数据。