Graph Neural Networks for Molecules

作者：Yuyang Wang, Zijie Li, Amir Barati Farimani · 发表于：Challenges and advances in computational chemistry and physics · 年份：2023 · DOI：10.1007/978-3-031-37196-7_2 · 被引用次数：77 · 研究领域：Computational Drug Discovery Methods、Machine Learning in Materials Science、Protein Structure and Dynamics