Design of Organic Electronic Materials With a Goal-Directed Generative Model Powered by Deep Neural Networks and High-Throughput Molecular Simulations
基于深度神经网络和高通量分子模拟的目标导向生成模型的有机电子材料设计
期刊:Frontiers in Chemistry
影响因子:4.2
doi:10.3389/fchem.2021.800370
Kwak, H Shaun; An, Yuling; Giesen, David J; Hughes, Thomas F; Brown, Christopher T; Leswing, Karl; Abroshan, Hadi; Halls, Mathew D