M 3 -20M是一个大规模的多模态分子数据集,包含超过2000万个分子,旨在支持AI驱动的药物设计和发现。数据集提供了多种模态,如一维SMILES字符串、二维分子图、三维分子结构、物理化学性质和文本描述。它支持多种下游任务,如分子生成、分子性质预测、先导化合物优化、虚拟筛选、药代动力学建模和药物-靶点相互作用预测。数据集整合了来自多个来源的数据,提供了每个分子的全面视图。
NGS data for mRNA display outcomes of LazBCDEF substrate preference profiling. The study utilized the substrate preference data to enable deep learning-driven library design for de novo discovery of b
The North America Artificial Intelligence Drug Development market report offers a thorough competitive analysis, mapping key players’ strategies, market share, and business models. It provides insight