De novo generation of optically active small organic molecules using Monte Carlo tree search combined with recurrent neural network

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作者
机构
[1] Tashiro, Motomichi
[2] Imamura, Yutaka
[3] 3,Katouda, Michio
来源
Tashiro, Motomichi (tashiro046@toyo.jp) | 1600年 / John Wiley and Sons Inc卷 / 42期
基金
日本学术振兴会;
关键词
Trajectories - Monte Carlo methods - Dichroism - Excited states - Recurrent neural networks;
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