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Updated: Jan 23, 2026

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合成适用性领域 (SynAD):导航化学空间可靠的人工智能驱动的反应预测.

Zhenzhi Tan1, Qi Yang1,2, Long Zhang1,3

  • 1Center of Basic Molecular Science, Department of Chemistry, Tsinghua University, Beijing, 100084, P.R. China.

Angewandte Chemie (International ed. in English)
|January 22, 2026
PubMed
概括

本研究介绍了SynAD,这是一种机器学习框架,用于定义有机合成中人工智能 (AI) 模型的可靠化学空间. SynAD帮助化学家们相信AI的预测,并专注于实验,加速新发现.

关键词:
机器学习 机器学习有机合成 有机合成预测反应反应的预测.乌尔曼反应的反应不确定性评估不确定性评估

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